SCHEMBL8545824

SCHEMBL8545824

NC(=O)N(O)Cc1ccc(Oc2ccccc2Oc2ccc(CN(O)C(N)=O)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 11/20 0.49
LPAR5 Q9H1C0 11/20 0.49
CARM1 Q86X55 1/20 0.48
PRMT6 Q96LA8 1/20 0.48
ALOX5 P09917 4/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46

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
SCHEMBL8546442 0.88 ALOX5 (0.51) ALOX5PTGS1PTGS2
SCHEMBL8550646 0.83 ALOX5 (0.52) ALOX5PTGS1PTGS2
SCHEMBL6037547 0.79 ALOX5 (0.56) ALOX5PTGS1PTGS2
SCHEMBL9474556 0.78 ALOX5 (0.74) ALOX5PTGS1PTGS2
SCHEMBL8546788 0.78 ALOX5 (0.45) ALOX5PTGS1PTGS2
SCHEMBL8545137 0.77 CARM1 (0.49) LPAR1LPAR5CARM1PRMT6ALOX5
SCHEMBL8549653 0.77 LPAR1 (0.46) LPAR1LPAR5ALOX5PTGS1PTGS2
SCHEMBL8550197 0.77 MMP2 (0.49) ALOX5PTGS1PTGS2
SCHEMBL8546575 0.76 F10 (0.45) ALOX5PTGS1PTGS2
SCHEMBL8545311 0.75 ITGB3 (0.49) ALOX5PTGS1PTGS2

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
EP-0696585-B1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMA CO LTD (JP) 1998-12-16 EP disclosed
US-5643931-A ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0696585-A1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 EP disclosed