SCHEMBL6735993

SCHEMBL6735993

NS(=O)(=O)c1cc(F)c(-c2c(-c3ccc(OC(F)(F)F)cc3)noc2C(F)(F)F)cc1F

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.43
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
TRPV1 Q8NER1 1/20 0.35
PTGS1 P23219 2/20 0.34
ABL1 P00519 1/20 0.34
BCR P11274 1/20 0.34
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34
ALOX5AP P20292 2/20 0.34
FEN1 P39748 2/20 0.34
FFAR4 Q5NUL3 1/20 0.34
ENPP2 Q13822 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
KIT P10721 1/20 0.33
KDR P35968 1/20 0.33
FLT3 P36888 1/20 0.33

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
SCHEMBL6735128 0.89 PTGES2 (0.41) PTGS2ESR1ESR2TRPV1PTGS1
SCHEMBL6733705 0.89 PTGS2 (0.47) PTGS2TRPV1PTGS1TP53MAPT
SCHEMBL6733422 0.88 PTGS2 (0.55) PTGS2ESR1ESR2PTGS1F2
SCHEMBL6723675 0.88 PTGS2 (0.47) PTGS2ESR1ESR2TRPV1PTGS1
SCHEMBL6733282 0.87 PTGS2 (0.46) PTGS2ESR1ESR2PTGS1F2
SCHEMBL6734527 0.86 PTGS2 (0.45) PTGS2ESR1ESR2PTGS1F2
SCHEMBL6739862 0.86 PTGS2 (0.47) PTGS2ESR1ESR2PTGS1F2
SCHEMBL6728715 0.86 PTGS2 (0.45) PTGS2ESR1ESR2PTGS1F2
SCHEMBL6737328 0.86 PTGS2 (0.52) PTGS2ESR1ESR2PTGS1F2
SCHEMBL6739332 0.86 PTGS2 (0.36) PTGS2TRPV1PTGS1ABL1BCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-07-15 US claimed
US-6673818-B2 TREATING CYCLOOXYGENASE-2 MEDIATED DISORDERS, SUCH AS ARTHRITIS, PAIN, FEVER AND CANCER PHARMACIA CORPORATION 2004-01-06 US claimed
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-08-07 US claimed
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-02-13 US claimed
EP-1251126-A2 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation Pharmacia Corporation (US) 2002-10-23 EP claimed
US-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-07-15 US disclosed
US-6699884-B2 ANTIINFLAMMATORY CYCLOOXYGENASE INHIBITORS. PHARMACIA CORPORATION 2004-03-02 US disclosed
US-6673818-B2 TREATING CYCLOOXYGENASE-2 MEDIATED DISORDERS, SUCH AS ARTHRITIS, PAIN, FEVER AND CANCER PHARMACIA CORPORATION 2004-01-06 US disclosed
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-08-07 US disclosed
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-02-13 US disclosed
EP-1251126-A2 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation Pharmacia Corporation (US) 2002-10-23 EP 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 (3 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-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885ESR1 1259/4885ESR2 201/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885ESR1 1259/4885ESR2 201/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885ESR1 1259/4885ESR2 201/4885

“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.