SCHEMBL10832640

SCHEMBL10832640

O=C(c1ccc(Cl)cc1)N1CCNC1=Nc1c(Cl)cccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GPR6 P46095 1/20 0.43
▸ POLB P06746 2/20 0.40
▸ AVPR2 P30518 1/20 0.40
▸ AVPR1A P37288 1/20 0.40
▸ MGLL Q99685 4/20 0.38
▸ MAPT P10636 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PHGDH O43175 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ SLC6A7 Q99884 1/20 0.36

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
SCHEMBL10832169 0.92 GPR6 (0.40) GPR6POLBAVPR2AVPR1AMGLL
Benclonidine SCHEMBL10831623 0.91 NOS1 (0.42) GPR6MGLLMAPTALDH1A1MEN1
Benclonidine SCHEMBL10831619 0.91 NOS1 (0.42) GPR6MGLLMAPTALDH1A1MEN1
SCHEMBL10832582 0.90 GPR6 (0.42) GPR6MGLLMAPTRAB9A
SCHEMBL10832574 0.90 HPGD (0.38) GPR6POLBAVPR2AVPR1AMGLL
SCHEMBL10832807 0.88 SLC6A7 (0.39) MAPTGAAALDH1A1SLC6A7
SCHEMBL10832370 0.88 SLC6A7 (0.39) MAPTGAAALDH1A1SLC6A7
SCHEMBL10831801 0.88 GPR6 (0.42) GPR6POLBAVPR2AVPR1AMGLL
SCHEMBL10832162 0.88 KCNN4 (0.44) MGLLMAPTALDH1A1
SCHEMBL10832451 0.87 GPR6 (0.45) GPR6POLBMGLLMAPTGAA

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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