SCHEMBL10832397

SCHEMBL10832397

CCOc1ccc(C(=O)N2CCNC2=Nc2c(Cl)cccc2Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ MAPT P10636 5/20 0.46
▸ HPGD P15428 4/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ HSD17B10 Q99714 1/20 0.44
▸ PKM P14618 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ LMNA P02545 5/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ POLB P06746 2/20 0.39
▸ TP53 P04637 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
SCHEMBL11217450 1.00 NPC1 (0.47) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL10833186 0.94 MAPT (0.45) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL10832485 0.92 ALDH1A1 (0.47) NPC1RAB9AMAPTHPGDALDH1A1
SCHEMBL10832129 0.89 NPC1 (0.47) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL10832451 0.88 GPR6 (0.45) RAB9AMAPTHPGDKDM4EALDH1A1
SCHEMBL10832341 0.86 DRD2 (0.38) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL10831620 0.85 ALDH1A1 (0.45) MAPTHPGDKDM4EALDH1A1KMT2A
SCHEMBL10832640 0.84 GPR6 (0.43) RAB9AMAPTHPGDALDH1A1KMT2A
Benclonidine SCHEMBL10831623 0.83 NOS1 (0.42) MAPTHPGDALDH1A1KMT2AMEN1
Benclonidine SCHEMBL10831619 0.83 NOS1 (0.42) MAPTHPGDALDH1A1KMT2AMEN1

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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