SCHEMBL6801877

SCHEMBL6801877

CS(=O)(=O)c1ccccc1-c1ccc(O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.49
ABL1 P00519 2/20 0.47
ABCB1 P08183 2/20 0.47
BCR P11274 2/20 0.47
ENPP2 Q13822 1/20 0.47
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
RAB9A P51151 1/20 0.45
FABP1 P07148 1/20 0.44
PTPN1 P18031 1/20 0.43
BACE1 P56817 1/20 0.43
ESR2 Q92731 1/20 0.43
BRD9 Q9H8M2 1/20 0.42
BAZ2B Q9UIF8 1/20 0.42
BAZ2A Q9UIF9 1/20 0.42
ALOX5AP P20292 1/20 0.42
FEN1 P39748 1/20 0.42
MMP3 P08254 1/20 0.41
BCL2L1 Q07817 1/20 0.41
FYN P06241 1/20 0.41

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
SCHEMBL8658514 0.84 PTGS2 (0.62) PTGS2KDM4EALDH1A1RAB9AALOX5AP
SCHEMBL937206 0.84 PTGS2 (0.61) PTGS2KDM4EALDH1A1RAB9AHSD11B1
SCHEMBL29415408 0.84 PTGS2 (0.61) PTGS2KDM4EALDH1A1RAB9AHSD11B1
SCHEMBL890902 0.82 ABL1 (0.48) ABL1ABCB1BCRRAB9AFABP1
SCHEMBL7265178 0.82 PTGS2 (0.50) PTGS2KDM4EALDH1A1RAB9ABAZ2B
Hydrochloric Acid SCHEMBL7352630 0.82 PTGS2 (0.59) PTGS2KDM4EALDH1A1RAB9AHSD11B1
SCHEMBL2447766 0.82 PTGS2 (0.64) PTGS2KDM4EALDH1A1RAB9A
SCHEMBL6901981 0.81 PTGS2 (0.68) PTGS2KDM4EALDH1A1RAB9AALOX5AP
SCHEMBL6904881 0.81 PTGS2 (0.68) PTGS2KDM4EALDH1A1RAB9AALOX5AP
SCHEMBL3830209 0.81 PTGS2 (0.48) PTGS2KDM4EALDH1A1RAB9AALOX5AP

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours MERCK PATENT GMBH (DE) 2004-05-13 US disclosed
EP-1370522-A1 PHENYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF THROMBOEMBOLIC DISORDERS OR TUMOURS MERCK PATENT GmbH (DE) 2003-12-17 EP disclosed
WO-2002070471-A1 PHENYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF THROMBOEMBOLIC DISORDERS OR TUMOURS MERCK PATENT GMBH (DE) 2002-09-12 WO 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 (1 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-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours RCOR3, F2, NCOR2 PTGS2 380/4885ABL1 3501/4885ABCB1 1875/4885

“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.