SCHEMBL7813896

SCHEMBL7813896

CS(=O)(=O)c1ccc(C(=O)c2cc(F)cc(F)c2)cc1

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.50
PTGS1 P23219 1/20 0.50
AKR1C3 P42330 2/20 0.48
AKR1C2 P52895 1/20 0.48
AKR1C1 Q04828 1/20 0.48
ESR1 P03372 1/20 0.45

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
SCHEMBL4030635 0.87 PTGS2 (0.62) PTGS2PTGS1AKR1C3AKR1C2AKR1C1
SCHEMBL7810450 0.85 PTGS2 (0.58) PTGS2PTGS1AKR1C3
SCHEMBL4321082 0.84 ENPP2 (0.58) PTGS2AKR1C3
SCHEMBL7810345 0.81 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL6583948 0.79 PTGS2 (0.57) PTGS2AKR1C3
SCHEMBL7813780 0.79 MAOB (0.50) PTGS2AKR1C3AKR1C2AKR1C1
SCHEMBL1069077 0.78 LTA4H (0.59)
SCHEMBL7811336 0.78 HDAC1 (0.50) PTGS2PTGS1
SCHEMBL3468270 0.77 ENPP2 (0.75) PTGS2ESR1
SCHEMBL6583952 0.77 PTGS2 (0.65) PTGS2AKR1C3AKR1C2AKR1C1

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
EP-0891345-B1 NOVEL FURAN DIARYLMETHYLIDENE DERIVATIVES, METHOD FOR THEIR PREPARATION AND THERAPEUTICAL USES THEREOF UNION PHARMA SCIENT APPL (FR) 2001-08-16 EP disclosed
US-6180651-B1 ANTIINFLAMMATORY AGENTS; ANALGESICS BRISTOL-MYERS SQUIBB 2001-01-30 US disclosed
WO-2000014082-A1 DIARYLMETHYLIDENE FURAN DERIVATIVES AS DRUGS WITH ANTI-INFLAMMATORY, ANALGESIC AND CHEMOPREVENTIVE PROPERTIES LABORATORIES UPSA (FR) 2000-03-16 WO disclosed
EP-0891345-A1 NOVEL FURAN DIARYLMETHYLIDENE DERIVATIVES, METHOD FOR THEIR PREPARATION AND THERAPEUTICAL USES THEREOF LABORATOIRES UPSA (FR) 1999-01-20 EP disclosed
US-5807873-A Diarylmethylidenefuran derivatives and their uses in therapeutics LABORATORIES UPSA (FR) 1998-09-15 US disclosed
WO-1997037984-A1 NOVEL FURAN DIARYLMETHYLIDENE DERIVATIVES, METHOD FOR THEIR PREPARATION AND THERAPEUTICAL USES THEREOF LABORATOIRES UPSA (FR) 1997-10-16 WO disclosed