SCHEMBL7811336

SCHEMBL7811336

Cc1ccc(C(=O)c2ccc(S(C)(=O)=O)cc2)cc1F

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
PTGS2 P35354 7/20 0.48
PTGS1 P23219 1/20 0.47
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 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
SCHEMBL7810345 0.87 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL18193764 0.81 ALDH1A1 (0.61) HDAC1HDAC6PTGS2HTTSMN1; SMN2
SCHEMBL4321082 0.80 ENPP2 (0.58) PTGS2
SCHEMBL7810601 0.80 HDAC1 (0.47) HDAC1HDAC6HTTSMN1; SMN2
SCHEMBL13176760 0.80 HDAC1 (0.56) HDAC1HDAC6HTTSMN1; SMN2
SCHEMBL7813955 0.79 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL4030635 0.79 PTGS2 (0.62) PTGS2PTGS1
SCHEMBL3757908 0.79 PTGS2 (0.54) PTGS2
SCHEMBL31379788 0.78 HDAC1 (0.59) HDAC1HDAC6HTTSMN1; SMN2
SCHEMBL7813896 0.78 PTGS2 (0.50) 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 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