SCHEMBL8545736

SCHEMBL8545736

O=c1[nH]c(=O)n(Cc2ccc(OCCCCCCCOc3ccc(Cn4oc(=O)[nH]c4=O)cc3)cc2)o1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.53
PLAT P00750 6/20 0.43
PLA2G2A P14555 2/20 0.43
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
TP53 P04637 2/20 0.39
HPGD P15428 1/20 0.39
S1PR1 P21453 5/20 0.38
S1PR3 Q99500 4/20 0.38
S1PR5 Q9H228 4/20 0.38
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP9 P14780 1/20 0.37

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
SCHEMBL8546450 1.00 FFAR1 (0.53) FFAR1PLATPLA2G2AALDH1A1MAPT
SCHEMBL8548551 1.00 FFAR1 (0.53) FFAR1PLATPLA2G2AALDH1A1MAPT
SCHEMBL8550554 1.00 FFAR1 (0.53) FFAR1PLATPLA2G2AALDH1A1MAPT
SCHEMBL8547591 1.00 FFAR1 (0.53) FFAR1PLATPLA2G2AALDH1A1MAPT
SCHEMBL8547419 1.00 FFAR1 (0.53) FFAR1PLATPLA2G2AALDH1A1MAPT
SCHEMBL8548383 1.00 FFAR1 (0.53) FFAR1PLATPLA2G2AALDH1A1MAPT
SCHEMBL8546840 1.00 FFAR1 (0.53) FFAR1PLATPLA2G2AALDH1A1MAPT
SCHEMBL8551167 0.98 FFAR1 (0.53) FFAR1PLATPLA2G2AALDH1A1MAPT
SCHEMBL8547496 0.95 FFAR1 (0.53) FFAR1PLATPLA2G2AALDH1A1MAPT
SCHEMBL8549621 0.94 FFAR1 (0.54) FFAR1PLATPLA2G2AALDH1A1MAPT

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