SCHEMBL9631003

SCHEMBL9631003

CCOC(=O)C(Cl)Cc1ccc(C)c(OCC2(C)CC(=O)c3cc(OC(C)=O)c(C(C)(C)C)cc3O2)c1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.34
ALDH1A1 P00352 7/20 0.34
GAA P10253 5/20 0.34
HPGD P15428 5/20 0.34
CASP1 P29466 4/20 0.34
HSD17B10 Q99714 4/20 0.34
KMT2A Q03164 1/20 0.32
GLA P06280 3/20 0.31
CASP7 P55210 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP1A1 P04798 1/20 0.31
MAOB P27338 1/20 0.30
AKT1 P31749 1/20 0.30

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
SCHEMBL10640285 0.91 KDM4E (0.39) KDM4EALDH1A1GAAHPGDCASP1
SCHEMBL9630834 0.84 KDM4E (0.37) KDM4EALDH1A1GAAHPGDCASP1
SCHEMBL10639179 0.84 KDM4E (0.41) KDM4EALDH1A1GAAHPGDCASP1
SCHEMBL9632113 0.82 CYP1A1 (0.35) KDM4EALDH1A1GAAHPGDCASP1
SCHEMBL9531337 0.81 KDM4E (0.40) KDM4EALDH1A1GAAHPGDCASP1
SCHEMBL10639070 0.80 KDM4E (0.39) KDM4EALDH1A1GAAHPGDCASP1
SCHEMBL9633233 0.80 RECQL (0.37) KDM4EALDH1A1GAAHPGDCASP1
SCHEMBL10635622 0.79 F2 (0.36)
SCHEMBL10641754 0.78 KDM4E (0.47) KDM4EALDH1A1GAAHPGDCASP1
SCHEMBL10642759 0.77 KDM4E (0.41) KDM4EALDH1A1GAAHPGDCASP1

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
US-5104888-A Anticholesterol or antidiabetic agents SANKYO COMPANY, LIMITED (JP) 1992-04-14 US disclosed
EP-0207581-B1 THIAZOLIDINE DERIVATIVES, THEIR PREPARATION AND USE SANKYO COMPANY LIMITED (JP) 1990-09-12 EP disclosed
EP-0207581-A2 Thiazolidine derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1987-01-07 EP disclosed