SCHEMBL213844

SCHEMBL213844

CC(=O)c1cccn2c(-c3ccc(F)cc3)c(-c3ccccc3S(C)(=O)=O)nc12

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.43
PTGS1 P23219 1/20 0.43
BAZ2B Q9UIF8 3/20 0.42
BAZ2A Q9UIF9 3/20 0.42
BRD9 Q9H8M2 1/20 0.42
ALOX5 P09917 1/20 0.41
AKT1 P31749 5/20 0.41
AKT2 P31751 5/20 0.41
IDO1 P14902 3/20 0.40
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
GRIA1 P42261 3/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL213843 0.84 PTGS2 (0.58) PTGS2PTGS1AKT1AKT2GRIA1
SCHEMBL13743031 0.79 GRIA1 (0.45) PTGS2PTGS1AKT1AKT2IDO1
SCHEMBL8566256 0.77 PTGS1 (0.46) PTGS2PTGS1AKT1AKT2KDM4E
SCHEMBL13751999 0.73 AKT1 (0.43) PTGS2PTGS1AKT1AKT2IDO1
SCHEMBL8566547 0.73 AKT1 (0.55) PTGS2PTGS1AKT1AKT2
SCHEMBL13866614 0.73 AKT1 (0.42) PTGS2PTGS1AKT1AKT2IDO1
SCHEMBL7844766 0.70 PTGS2 (0.49) PTGS2PTGS1ALOX5
SCHEMBL8560259 0.69 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL8564918 0.68 PTGS2 (0.60) PTGS2PTGS1ALOX5AKT1AKT2
SCHEMBL7842566 0.68 PTGS2 (0.49) PTGS2PTGS1ALOX5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 158 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1463500-A1 USE OF COX-2 INHIBITORS IN COMBINATION WITH ANTIVIRAL AGENTS FOR THE TREATMENT OF PAPILLOMA VIRUS INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 2004-10-06 EP claimed
US-20040186154-A1 Therapeutic combinations for cardiovascular and inflammatory indications SEIBERT KAREN (US) 2004-09-23 US claimed
US-20040044028-A1 Combinations of omega-3 fatty acids and cyclooxygenase-2 inhibitors for treatment or prevention of cardiovascular disease and treatment or prevention of cancer PHARMACIA CORPORATION 2004-03-04 US claimed
US-20030211163-A1 Combination antiviral therapy PHARMACIA & UPJOHN COMPANY 2003-11-13 US claimed
US-20030199482-A1 Therapeutic combinations for cardiovascular and inflammatory indications PHARMACIA CORPORATION 2003-10-23 US claimed
WO-2003059347-A1 USE OF COX-2 INHIBITORS IN COMBINATION WITH ANTIVIRAL AGENTS FOR THE TREATMENT OF PAPILLOMA VIRUS INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 2003-07-24 WO claimed
US-20030119895-A1 Methods using a combination of a 3-heteroaryl-2-indolinone and a cyclooxygenase-2 inhibitor for the treatment of neoplasia PHARMACIA CORPORATION 2003-06-26 US claimed
US-20030114418-A1 Method for the treatment and prevention of pain and inflammation with glucosamine and a cyclooxygenase-2 selective inhibitor and compositions therefor PHARMACIA CORPORATION 2003-06-19 US claimed
US-20030114416-A1 Method and compositions for the treatment and prevention of pain and inflammation with a cyclooxygenase-2 selective inhibitor and chondroitin sulfate PHARMACIA CORPORATION 2003-06-19 US claimed
US-20020035156-A1 Combination therapy in the prevention of cardiovascular disorders RONIKER BARBARA (US) 2002-03-21 US claimed
US-11957657-B2 Combination therapies using immuno-dash inhibitors and PGE2 antagonists TRUSTEES OF TUFTS COLLEGE (US) 2024-04-16 US disclosed
US-20230390241-A1 DASH INHIBITORS, AND USES RELATED THERETO TRUSTEES OF TUFTS COLLEGE 2023-12-07 US disclosed
US-20230372372-A1 COMBINATION THERAPIES USING CASPASE-1 DEPENDENT ANTICANCER AGENTS AND PGE2 ANTAGONISTS TRUSTEES OF TUFTS COLLEGE 2023-11-23 US disclosed
US-11583516-B2 Dash inhibitors, and uses related thereto TRUSTEES OF TUFTS COLLEGE (US) 2023-02-21 US disclosed
US-11559537-B2 Combination therapies using caspase-1 dependent anticancer agents and PGE2 antagonists TRUSTEES OF TUFTS COLLEGE (US) 2023-01-24 US disclosed
US-20030114418-A1 Method for the treatment and prevention of pain and inflammation with glucosamine and a cyclooxygenase-2 selective inhibitor and compositions therefor PHARMACIA CORPORATION 2003-06-19 US disclosed
US-20030114416-A1 Method and compositions for the treatment and prevention of pain and inflammation with a cyclooxygenase-2 selective inhibitor and chondroitin sulfate PHARMACIA CORPORATION 2003-06-19 US disclosed
US-20030013739-A1 Methods of using a combination of cyclooxygenase-2 selective inhibitors and thalidomide for the treatment of neoplasia PHARMACIA CORPORATION 2003-01-16 US disclosed
WO-2002096516-A1 USE OF COMPOSITIONS COMPRISING CYCLOOXYGENASE-2 SELECTIVE INHIBITORS IN COMBINATION WITH RADIATION FOR INHIBITION OR PREVENTION OF CARDIOVASCULAR DISEASE PHARMACIA CORPORATION (US) 2002-12-05 WO disclosed
US-20020035156-A1 Combination therapy in the prevention of cardiovascular disorders RONIKER BARBARA (US) 2002-03-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030211163-A1 Combination antiviral therapy EIF2AK2, ZC3HAV1, VHL PTGS2 1846/4885PTGS1 1821/4885BAZ2B 277/4885
US-20230390241-A1 DASH INHIBITORS, AND USES RELATED THERETO CD2BP2, PCNA, CD2 PTGS2 2358/4885PTGS1 1824/4885BAZ2B 290/4885
US-20030119895-A1 Methods using a combination of a 3-heteroaryl-2-indolinone and a cyclooxygenase-2 inhibitor for the treatment of neoplasia PTGS2, PTGES2, PTGS1 PTGS2 1/4885PTGS1 3/4885BAZ2B 1534/4885
US-11583516-B2 Dash inhibitors, and uses related thereto PCNA, CD2BP2, CCNO PTGS2 2466/4885PTGS1 1875/4885BAZ2B 297/4885
US-20030114416-A1 Method and compositions for the treatment and prevention of pain and inflammation with a cyclooxygenase-2 selective inhibitor and chondroitin sulfate CSGALNACT1, PTGS2, PTGS1 PTGS2 2/4885PTGS1 3/4885BAZ2B 4496/4885
US-20040044028-A1 Combinations of omega-3 fatty acids and cyclooxygenase-2 inhibitors for treatment or prevention of cardiovascular disease and treatment or prevention of cancer PTGES3, PTGER3, PTGES2 PTGS2 8/4885PTGS1 15/4885BAZ2B 2713/4885
US-11559537-B2 Combination therapies using caspase-1 dependent anticancer agents and PGE2 antagonists CASP1, CASP2, APAF1 PTGS2 24/4885PTGS1 11/4885BAZ2B 1424/4885
US-20030013739-A1 Methods of using a combination of cyclooxygenase-2 selective inhibitors and thalidomide for the treatment of neoplasia PTGS2, PTGES2, PTGS1 PTGS2 1/4885PTGS1 3/4885BAZ2B 1215/4885
US-20230372372-A1 COMBINATION THERAPIES USING CASPASE-1 DEPENDENT ANTICANCER AGENTS AND PGE2 ANTAGONISTS CASP1, CASP2, APAF1 PTGS2 24/4885PTGS1 11/4885BAZ2B 1424/4885
US-11957657-B2 Combination therapies using immuno-dash inhibitors and PGE2 antagonists HPGDS, PTGIS, PTGDR2 PTGS2 19/4885PTGS1 16/4885BAZ2B 631/4885
US-20020035156-A1 Combination therapy in the prevention of cardiovascular disorders FABP3, TNNT2, TNNI3 PTGS2 6/4885PTGS1 20/4885BAZ2B 2797/4885
US-20030199482-A1 Therapeutic combinations for cardiovascular and inflammatory indications HMGCR, HMGB2, HMGB3 PTGS2 7/4885PTGS1 18/4885BAZ2B 3458/4885
US-20040186154-A1 Therapeutic combinations for cardiovascular and inflammatory indications HMGCR, HMGB2, HMGB3 PTGS2 7/4885PTGS1 18/4885BAZ2B 3458/4885
US-20030114418-A1 Method for the treatment and prevention of pain and inflammation with glucosamine and a cyclooxygenase-2 selective inhibitor and compositions therefor PTGS2, PTGS1, UGGT1 PTGS2 1/4885PTGS1 2/4885BAZ2B 4512/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.