SCHEMBL28096227

SCHEMBL28096227

CCC(O)c1cc(C(=O)OC(Cl)=CCl)ccc1C1CC1

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.31
GBA1 P04062 1/20 0.31
RARG P13631 2/20 0.31
RARB P10826 1/20 0.31
CNR2 P34972 1/20 0.30
USP2 O75604 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 1/20 0.30
ROCK2 O75116 1/20 0.30
ROCK1 Q13464 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
SCHEMBL28324373 0.86 USP2 (0.31) IDO1GBA1USP2MAPTALOX15
SCHEMBL28096228 0.80 CREBBP (0.39) RARGRARBUSP2MAPTALOX15
Vinyl Chloride SCHEMBL28324374 0.79 CREBBP (0.39) RARGRARBUSP2MAPTALOX15
SCHEMBL15545010 0.78 CREBBP (0.43) RARGRARBUSP2MAPTALOX15
SCHEMBL31401258 0.62 CREBBP (0.46) RARGRARB
SCHEMBL3139752 0.62 CHRM1 (0.48)
SCHEMBL662058 0.62 CA12 (0.50) ALOX15MAPK1
SCHEMBL20243845 0.61 ALDH1A1 (0.48) MAPTALOX15HSD17B10
SCHEMBL19155007 0.61 CHRNB2 (0.45) MAPTALOX15HSD17B10
SCHEMBL25049608 0.61 CREBBP (0.48) MAPTMAPK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106061963-A Heterocyclic modulators of lipid synthesis and combinations thereof 3-V生物科学股份有限公司 2016-10-26 CN disclosed