SCHEMBL8548288

SCHEMBL8548288

NC(=O)N(O)Cc1ccc(OCc2cccc(COc3ccc(CN(O)C(N)=O)cc3)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.59
PTGS1 P23219 1/20 0.59
PTGS2 P35354 1/20 0.59
F2 P00734 2/20 0.54
PTPRC P08575 1/20 0.52
PTPN1 P18031 1/20 0.52
PARP10 Q53GL7 4/20 0.51
MAOB P27338 3/20 0.51
PARP15 Q460N3 1/20 0.51
PARP14 Q460N5 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.48
MAOA P21397 1/20 0.47

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
SCHEMBL9474556 0.90 ALOX5 (0.74) ALOX5PTGS1PTGS2PARP10L3MBTL1
SCHEMBL8550197 0.80 MMP2 (0.49) ALOX5PTGS1PTGS2L3MBTL1
SCHEMBL8550646 0.79 ALOX5 (0.52) ALOX5PTGS1PTGS2F2PARP10
SCHEMBL8545311 0.78 ITGB3 (0.49) ALOX5PTGS1PTGS2F2
SCHEMBL8546769 0.78 ITGB3 (0.49) ALOX5PTGS1PTGS2F2
SCHEMBL8549962 0.78 ITGB3 (0.49) ALOX5PTGS1PTGS2F2
SCHEMBL8546442 0.77 ALOX5 (0.51) ALOX5PTGS1PTGS2PARP10PARP15
SCHEMBL8547601 0.77 ALOX5 (0.46) ALOX5PTGS1PTGS2PARP10
SCHEMBL8547612 0.77 ALOX5 (0.46) ALOX5PTGS1PTGS2PARP10
SCHEMBL8552020 0.77 ALOX5 (0.46) ALOX5PTGS1PTGS2PARP10

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