SCHEMBL8879790

SCHEMBL8879790

CN(CCC1CCCN1C)CC(=O)N1c2ccccc2C(=O)Nc2cccnc21

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 5/20 0.61
CHRM4 P08173 3/20 0.60
CHRM1 P11229 3/20 0.60
USP2 O75604 1/20 0.59
ALDH1A1 P00352 1/20 0.59
LMNA P02545 1/20 0.59
CYP1A2 P05177 1/20 0.59
CHRM5 P08912 1/20 0.59
CYP2D6 P10635 1/20 0.59
CHRM3 P20309 1/20 0.59

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
Hydrochloric Acid SCHEMBL9870848 0.99 CHRM2 (0.60) CHRM2CHRM4CHRM1USP2ALDH1A1
SCHEMBL10459903 0.98 CHRM2 (0.62) CHRM2CHRM4CHRM1CYP1A2CHRM3
SCHEMBL8879186 0.97 CHRM2 (0.61) CHRM2CHRM4CHRM1CYP1A2CHRM3
SCHEMBL10519813 0.93 CHRM2 (0.61) CHRM2CHRM4CHRM1CYP1A2CHRM3
SCHEMBL10513054 0.90 CHRM2 (0.57) CHRM2CHRM4CHRM1CYP1A2CHRM3
SCHEMBL9870176 0.90 CHRM2 (0.67) CHRM2CHRM4CHRM1CYP1A2CHRM5
SCHEMBL9870460 0.89 CHRM2 (0.59) CHRM2CHRM4CHRM1CHRM5CHRM3
SCHEMBL10522160 0.89 CYP1A2 (0.68) CHRM2CHRM4CHRM1CYP1A2CHRM3
Hydrochloric Acid SCHEMBL9870956 0.88 CHRM2 (0.58) CHRM2CHRM4CHRM1CHRM5CHRM3
SCHEMBL10515607 0.88 CYP1A2 (0.51) CHRM2CHRM4CHRM1CYP1A2CHRM3

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0346745-A1 Condensed diazepinones, processes for their preparation and pharmaceutical preparations containing them Dr. Karl Thomae GmbH (DE) 1989-12-20 EP claimed
JP-2040381-A None JP disclosed
US-5641772-A Condensed diazepinones, processes for preparing them and agents containing these compounds for treating diseases of the central nervous system and for promoting cerebral blood circulation DR. KARL THOMAE GMBH (DE) 1997-06-24 US disclosed
US-5610155-A ALZHEIMER'S DR. KARL THOMAE GMBH (DE) 1997-03-11 US disclosed
EP-0508370-B1 Condensed diazepinones, process for their preparation and compositions containing them for the treatment of the central nervous system and to enhance cerebral perfusion THOMAE GMBH DR K (DE) 1996-07-03 EP disclosed
EP-0508370-A1 Condensed diazepinones, process for their preparation and compositions containing them for the treatment of the central nervous system and to enhance cerebral perfusion Dr. Karl Thomae GmbH (DE) 1992-10-14 EP disclosed
US-5002943-A Antispasmodic Agents, Bradycardia Treatment MIHM GERHARD (DE) 1991-03-26 US disclosed
JP-H0240381-A NEW CONDENSED DIAZEPINONES, PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THESE COMPOUNDS DR KARL THOMAE GMBH 1990-02-09 JP disclosed
EP-0346745-A1 Condensed diazepinones, processes for their preparation and pharmaceutical preparations containing them Dr. Karl Thomae GmbH (DE) 1989-12-20 EP disclosed