SCHEMBL8545528

SCHEMBL8545528

NC(=O)N(Cc1ccc(Oc2ccc(CN(OCc3ccccc3)C(N)=O)cc2)cc1)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.48
ALOX5 P09917 3/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
PARP10 Q53GL7 2/20 0.44
PTGES O14684 1/20 0.44
FFAR1 O14842 3/20 0.43
FFAR4 Q5NUL3 1/20 0.43
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42
SRD5A2 P31213 1/20 0.42

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
SCHEMBL8547009 1.00 NR3C1 (0.48) NR3C1ALOX5PTGS1PTGS2L3MBTL1
SCHEMBL8546496 0.93 NR3C1 (0.47) NR3C1ALOX5PTGESFFAR1FFAR4
SCHEMBL8549653 0.93 LPAR1 (0.46) NR3C1ALOX5PTGS1PTGS2L3MBTL1
SCHEMBL8549623 0.91 NR3C1 (0.43) NR3C1ALOX5PTGS1PTGS2L3MBTL1
SCHEMBL5320045 0.91 PARP10 (0.44) ALOX5PTGS1PTGS2L3MBTL1PARP10
SCHEMBL8550259 0.88 PLA2G10 (0.49) ALOX5PTGS1PTGS2L3MBTL1PARP10
SCHEMBL8550313 0.87 MEN1 (0.49) ALOX5PTGS1PTGS2L3MBTL1PARP10
SCHEMBL8545520 0.87 PPIB (0.51) ALOX5PTGS1PTGS2L3MBTL1PARP10
SCHEMBL8546552 0.86 MEN1 (0.48) ALOX5PTGS1PTGS2L3MBTL1PARP10
SCHEMBL8549400 0.82 PARP10 (0.49) ALOX5PTGS1PTGS2L3MBTL1PARP10

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