SCHEMBL9532944

SCHEMBL9532944

CC(=O)Oc1c(C(C)=O)cc2c(c1C)OC(C)(COc1ccc([N+](=O)[O-])cc1)CC2=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
MAPT P10636 4/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
KMT2A Q03164 6/20 0.39
MAOB P27338 1/20 0.36
KDM4E B2RXH2 5/20 0.35
MEN1 O00255 3/20 0.35
PKM P14618 1/20 0.35
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
HTT P42858 2/20 0.34
GAA P10253 3/20 0.34
LMNA P02545 2/20 0.34
AKT1 P31749 1/20 0.34
HPGD P15428 2/20 0.33
CASP1 P29466 2/20 0.33
HSD17B10 Q99714 2/20 0.33
GSTP1 P09211 1/20 0.33
GLA P06280 1/20 0.33

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
SCHEMBL9533475 0.88 ALDH1A1 (0.41) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL9530770 0.84 MAPT (0.42) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL8177483 0.82 KMT2A (0.39) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL9531214 0.82 KDM4E (0.37) ALDH1A1MAPTKMT2AMAOBKDM4E
SCHEMBL9534457 0.78 MAPT (0.45) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL9532298 0.75 ALDH1A1 (0.45) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL7123640 0.74 GAA (0.44) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL7536176 0.74 TTPA (0.51) MAPTKMT2AMEN1
SCHEMBL9531639 0.74 KMT2A (0.42) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL9533182 0.74 ALDH1A1 (0.47) ALDH1A1MAPTNPC1RAB9AKMT2A

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-0277836-B1 THIAZOLIDINONE DERIVATIVES, THEIR PREPARATION AND THEIR USE Sankyo Company Limited (JP) 1993-06-02 EP disclosed
US-4873255-A REDUCE BLOOD GLUCOSE AND BLOOD LIPID LEVELS SANKYO COMPANY LIMITED (JP) 1989-10-10 US disclosed
EP-0277836-A1 Thiazolidinone derivatives, their preparation and their use Sankyo Company Limited (JP) 1988-08-10 EP disclosed