SCHEMBL10831648

SCHEMBL10831648

CCCCOc1ccc(C(=O)N2CCNC2=Nc2c(Cl)cccc2Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.47
▸ HPGD P15428 5/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ MAPT P10636 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GAA P10253 3/20 0.41
▸ THRB P10828 2/20 0.40
▸ HRH2 P25021 3/20 0.40
▸ HRH1 P35367 3/20 0.40
▸ HTR2A P28223 2/20 0.39
▸ HTR1A P08908 1/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ MGAM O43451 1/20 0.39
▸ AMY1A P0DUB6 1/20 0.39
▸ SI P14410 1/20 0.39
▸ MGAM2 Q2M2H8 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
SCHEMBL10832485 0.96 ALDH1A1 (0.47) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL10832397 0.92 NPC1 (0.47) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL11217450 0.92 NPC1 (0.47) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL10832451 0.86 GPR6 (0.45) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL10833186 0.86 MAPT (0.45) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL10832149 0.85 ALDH1A1 (0.47) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL10832341 0.84 DRD2 (0.38) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL10831620 0.83 ALDH1A1 (0.45) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL10832640 0.82 GPR6 (0.43) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
Benclonidine SCHEMBL10831623 0.81 NOS1 (0.42) ALDH1A1HPGDMEN1KMT2AMAPT

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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