SCHEMBL8422669

SCHEMBL8422669

CCOC(=O)/C=C/CCc1ccc2ccccc2c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 4/20 0.51
MAPT P10636 3/20 0.51
CCNC P24863 1/20 0.46
CDK8 P49336 1/20 0.46
CYP1A2 P05177 2/20 0.44
CYP2A6 P11509 1/20 0.42
GAA P10253 1/20 0.42
PDPK1 O15530 1/20 0.42
TTR P02766 1/20 0.42
DPP4 P27487 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
SCHEMBL8422670 1.00 GPR52 (0.51) GPR52MAPTCCNCCDK8CYP1A2
SCHEMBL6777641 0.86 CCNC (0.48) MAPTCCNCCDK8CYP1A2CYP2A6
SCHEMBL6777638 0.86 CCNC (0.48) MAPTCCNCCDK8CYP1A2CYP2A6
SCHEMBL1268421 0.83 MAPT (0.62) GPR52MAPT
SCHEMBL1268422 0.83 MAPT (0.62) GPR52MAPT
SCHEMBL8424521 0.82 MAPT (0.48) GPR52MAPTTTRDPP4
SCHEMBL8424519 0.82 MAPT (0.48) GPR52MAPTTTRDPP4
SCHEMBL27310629 0.80 MAPT (0.59) GPR52MAPT
SCHEMBL27310628 0.80 MAPT (0.59) GPR52MAPT
SCHEMBL27311627 0.80 MAPT (0.59) GPR52MAPT

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
EP-0949238-A1 SUBSTITUTED PROPIONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-10-13 EP disclosed