SCHEMBL6746438

SCHEMBL6746438

Cc1cccc(-c2cccnc2-c2cc(F)c(S(N)(=O)=O)c(F)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 17/20 0.47
CYP2A6 P11509 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38

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
SCHEMBL6726057 0.86 TGFBR1 (0.48) TGFBR1ALOX5APFEN1
SCHEMBL6840807 0.84 TGFBR1 (0.45) TGFBR1CA1CA2
SCHEMBL6747196 0.84 CA1 (0.43) TGFBR1CA1CA2ALOX5APFEN1
SCHEMBL6749607 0.82 SCN9A (0.40) TGFBR1CA1CA2ALOX5APFEN1
SCHEMBL6743007 0.81 FEN1 (0.41) TGFBR1CA1CA2ALOX5APFEN1
SCHEMBL6746652 0.81 CA1 (0.40) TGFBR1CA1CA2ALOX5APFEN1
SCHEMBL6744788 0.81 PTGS2 (0.48) TGFBR1CA1CA2ALOX5APFEN1
SCHEMBL6750007 0.81 TGFBR1 (0.42) TGFBR1CYP2A6CA1CA2ALOX5AP
SCHEMBL6837996 0.81 CA1 (0.47) TGFBR1CA1CA2
SCHEMBL7040769 0.81 TGFBR1 (0.47) TGFBR1ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6699884-B2 ANTIINFLAMMATORY CYCLOOXYGENASE INHIBITORS. PHARMACIA CORPORATION 2004-03-02 US claimed