SCHEMBL6747337

SCHEMBL6747337

Cc1ccc(-c2cccnc2-c2cc(F)c(S(N)(=O)=O)c(F)c2)cc1OC(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 10/20 0.38
ALOX5AP P20292 9/20 0.38
PTGS1 P23219 4/20 0.37
PTGS2 P35354 4/20 0.37
SCN9A Q15858 2/20 0.36
TGFBR1 P36897 1/20 0.35
CYP2C9 P11712 1/20 0.34
SCN5A Q14524 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
CGAS Q8N884 1/20 0.34

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
SCHEMBL6746002 0.92 PTGS2 (0.41) FEN1ALOX5APPTGS1PTGS2SCN9A
SCHEMBL6723491 0.89 PTGS1 (0.39) FEN1ALOX5APPTGS1PTGS2SCN9A
SCHEMBL6839124 0.86 PTGS2 (0.36) PTGS1PTGS2SCN9ACYP2C9SCN5A
SCHEMBL6746864 0.86 FEN1 (0.42) FEN1ALOX5APPTGS1PTGS2TGFBR1
SCHEMBL6747442 0.85 PTGS2 (0.49) FEN1ALOX5APPTGS1PTGS2TGFBR1
SCHEMBL6746250 0.84 FEN1 (0.39) FEN1ALOX5APPTGS1PTGS2SCN9A
SCHEMBL6837154 0.84 CA1 (0.41) PTGS1PTGS2SCN9ATGFBR1CYP2C9
SCHEMBL6745515 0.84 ALOX5AP (0.38) FEN1ALOX5APPTGS1PTGS2SCN9A
SCHEMBL6746673 0.84 PTGS2 (0.42) FEN1ALOX5APPTGS1PTGS2SCN9A
SCHEMBL7046231 0.84 SYK (0.40) FEN1ALOX5APPTGS1PTGS2SCN9A

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

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