SCHEMBL10832444

SCHEMBL10832444

COc1ccc(C(=O)N2CCNC2=Nc2c(C)cccc2C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR6 P46095 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ RECQL P46063 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ BLM P54132 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.42
▸ DRD2 P14416 1/20 0.39
▸ DRD3 P35462 1/20 0.39

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
SCHEMBL10832702 0.92 GPR6 (0.42) GPR6SMN1; SMN2RAB9AKMT2ARECQL
SCHEMBL10832451 0.87 GPR6 (0.45) GPR6SMN1; SMN2RAB9AKMT2ARECQL
SCHEMBL10831801 0.86 GPR6 (0.42) GPR6SMN1; SMN2RAB9AKMT2AKDM4E
SCHEMBL10833186 0.81 MAPT (0.45) SMN1; SMN2RAB9AKMT2AKDM4EMEN1
SCHEMBL10832169 0.81 GPR6 (0.40) GPR6SMN1; SMN2RAB9AKDM4EMAPT
SCHEMBL10832587 0.80 SMN1; SMN2 (0.44) GPR6SMN1; SMN2RAB9AKMT2ARECQL
SCHEMBL10831654 0.79 SMN1; SMN2 (0.47) SMN1; SMN2KDM4EMAPTCYP2C19ALDH1A1
SCHEMBL10831650 0.79 SMN1; SMN2 (0.47) SMN1; SMN2KDM4EMAPTCYP2C19ALDH1A1
SCHEMBL10832175 0.79 GPR6 (0.38) GPR6KDM4E
SCHEMBL10832289 0.77 GPR6 (0.43) GPR6SMN1; SMN2KMT2AKDM4EMAPT

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-4581460-A ANALGESICS CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1986-04-08 — — US disclosed
EP-0083729-B1 SUBSTITUTED 1-BENZOYL-2-PHENYLIMINO-IMIDAZOLIDINES, THEIR ACID ADDITION SALTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1986-02-26 — — EP disclosed
EP-0083729-A1 Substituted 1-benzoyl-2-phenylimino-imidazolidines, their acid addition salts, process for their preparation and pharmaceutical compositions containing them CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1983-07-20 — — EP disclosed
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