SCHEMBL6165581

SCHEMBL6165581

COc1ccc2c(c1)CCc1c(C(F)F)nn(-c3ccc(S(C)(=O)=O)cn3)c1-2

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.44

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
SCHEMBL7230422 0.85 PTGS1 (0.47) PTGS2
SCHEMBL7228934 0.80 PTGS2 (0.46) PTGS2
SCHEMBL6344383 0.80 PTGS2 (0.56) PTGS2
SCHEMBL7042172 0.79 PTGS1 (0.45) PTGS2
SCHEMBL7045200 0.79 PTGS1 (0.48) PTGS2
SCHEMBL6165295 0.73 PTGS1 (0.47) PTGS2
SCHEMBL8689037 0.72 ACHE (0.41)
SCHEMBL8735027 0.71 PTGS2 (0.59) PTGS2
SCHEMBL7041609 0.70 PTGS1 (0.62) PTGS2
SCHEMBL6410104 0.68 PTGS2 (0.54) PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6538009-B2 Selective cyclooxygenase-2 (COX-2) inhibitors; for example, 1-(5-Methanesulfonyl-pyridin-2-yl)-7-methoxy-3-trifluoromethyl-4,5-dihydro -1H-benzo(g) indazole PFIZER, INC. 2003-03-25 US claimed
US-20020115856-A1 Pyrazole derivatives as anti-inflammatory/analgesic agents SAKYA SUBAS MAN (US) 2002-08-22 US claimed
EP-1233959-B1 HETEROCYCLO-ALKYLSULFONYL PYRAZOLE DERIVATIVES AS ANTI-INFLAMMATORY/ANALGESIC AGENTS PFIZER PROD INC (US) 2005-03-16 EP disclosed
US-20030236258-A1 Heterocyclo-alkylsulfonyl pyrazole derivatives as anti-inflammatory/analgesic agents PFIZER INC. 2003-12-25 US disclosed
US-6538009-B2 Selective cyclooxygenase-2 (COX-2) inhibitors; for example, 1-(5-Methanesulfonyl-pyridin-2-yl)-7-methoxy-3-trifluoromethyl-4,5-dihydro -1H-benzo(g) indazole PFIZER, INC. 2003-03-25 US disclosed
US-6531492-B1 Heterocyclo-alkylsulfonyl pyrazole derivatives as anti-inflammatory/analgesic agents PFIZER INC. 2003-03-11 US disclosed
US-20020115856-A1 Pyrazole derivatives as anti-inflammatory/analgesic agents SAKYA SUBAS MAN (US) 2002-08-22 US disclosed
EP-1142889-A1 Pyrazole derivatives as anti-inflammatory/analgesic agents Pfizer Products Inc. (US) 2001-10-10 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 (2 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-20030236258-A1 Heterocyclo-alkylsulfonyl pyrazole derivatives as anti-inflammatory/analgesic agents PTGS1, SULT2A1, PTGES3 PTGS2 4/4885
US-20020115856-A1 Pyrazole derivatives as anti-inflammatory/analgesic agents FPR3, P2RX3, FPR1 PTGS2 72/4885

“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.