SCHEMBL8638531

SCHEMBL8638531

Cc1cccc(-c2cc(C(F)(F)F)nn2NS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 9/20 0.54
PTGS1 P23219 6/20 0.54
RXRA P19793 3/20 0.43
NR1H2 P55055 3/20 0.43
NR1H3 Q13133 3/20 0.43
SDHB P21912 1/20 0.43
SYK P43405 1/20 0.42
MCL1 Q07820 1/20 0.41
PDPK1 O15530 1/20 0.41
MAPT P10636 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
SCHEMBL27967579 0.91 PDPK1 (0.45) PTGS2PTGS1RXRANR1H2NR1H3
SCHEMBL8640765 0.89 PTGS1 (0.51) PTGS2PTGS1RXRANR1H2NR1H3
SCHEMBL7135445 0.88 PTGS2 (0.51) PTGS2PTGS1PDPK1
SCHEMBL8637254 0.87 PTGS2 (0.53) PTGS2PTGS1RXRANR1H2NR1H3
SCHEMBL8641600 0.86 PTGS2 (0.44) PTGS2PTGS1RXRANR1H2NR1H3
SCHEMBL8641040 0.86 PTGS2 (0.48) PTGS2PTGS1RXRANR1H2NR1H3
SCHEMBL8693641 0.85 PTGS2 (0.44) PTGS2PTGS1RXRANR1H2NR1H3
SCHEMBL8641218 0.85 MAPT (0.46) PTGS2PTGS1RXRANR1H2NR1H3
SCHEMBL8641628 0.85 HPGD (0.45) PTGS2PTGS1RXRANR1H2NR1H3
SCHEMBL8636729 0.84 PTGS2 (0.43) PTGS2PTGS1RXRANR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5760068-A NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G.D. SEARLE & CO. (US) 1998-06-02 US claimed
US-5760068-A NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G.D. SEARLE & CO. (US) 1998-06-02 US disclosed
US-5756529-A ANTIINFLAMMATORY G.D. SEARLE & CO. (US) 1998-05-26 US disclosed
US-5753688-A ANTIINFLAMMATORY TALLEY JOHN J (US) 1998-05-19 US disclosed
US-5510496-A ANTIINFLAMMATORY AGENTS G.D. SEARLE & CO. (US) 1996-04-23 US disclosed
US-5504215-A Substituted pyrazolyl benzenesulfonamide compounds for the treatment of inflammation G. D. SEARLE & CO. (US) 1996-04-02 US disclosed