SCHEMBL8924318

SCHEMBL8924318

CS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)nn2C2CCCCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.63
PTGS1 P23219 6/20 0.54
CYP2C9 P11712 1/20 0.54
NR3C2 P08235 1/20 0.51

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
SCHEMBL16566078 0.89 NR1H2 (0.57) PTGS2PTGS1CYP2C9NR3C2
SCHEMBL29496568 0.89 NR1H2 (0.57) PTGS2PTGS1CYP2C9NR3C2
SCHEMBL6722182 0.85 NR3C2 (0.49) PTGS2PTGS1CYP2C9NR3C2
SCHEMBL6726463 0.84 NR3C2 (0.50) PTGS2PTGS1CYP2C9NR3C2
SCHEMBL27490490 0.84 PTGS2 (0.50) PTGS2PTGS1CYP2C9
SCHEMBL6734134 0.83 NR3C2 (0.47) PTGS2PTGS1CYP2C9NR3C2
SCHEMBL6734910 0.82 NR3C2 (0.47) PTGS2PTGS1CYP2C9NR3C2
SCHEMBL8925539 0.81 NR3C2 (0.49) PTGS2PTGS1NR3C2
SCHEMBL3865904 0.80 PTGS2 (0.71) PTGS2PTGS1
SCHEMBL3869780 0.80 PTGS2 (0.71) PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5670533-A ANTIINFLAMMATORY AGENTS, ANALGESICS OR ANTIRHEUMATIC DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-09-23 US disclosed
US-5550147-A ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTITHROMBOTIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-08-27 US disclosed
EP-0554829-A2 Pyrazole derivatives with antiinflammatory, analgesic and antithrombolic activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-08-11 EP disclosed