SCHEMBL8879186

SCHEMBL8879186

CN(CCC1CCCCCN1C)CC(=O)N1c2ccccc2C(=O)Nc2cccnc21

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.61
CHRM4 P08173 3/20 0.61
CHRM1 P11229 3/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CHRM3 P20309 1/20 0.61
MAPK1 P28482 1/20 0.61

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
SCHEMBL10459903 0.99 CHRM2 (0.62) CHRM2CHRM4CHRM1CYP1A2CYP3A4
SCHEMBL8879790 0.97 CHRM2 (0.61) CHRM2CHRM4CHRM1CYP1A2CHRM3
Hydrochloric Acid SCHEMBL9870848 0.96 CHRM2 (0.60) CHRM2CHRM4CHRM1CYP1A2CHRM3
SCHEMBL10519813 0.94 CHRM2 (0.61) CHRM2CHRM4CHRM1CYP1A2CYP3A4
SCHEMBL10513054 0.94 CHRM2 (0.57) CHRM2CHRM4CHRM1CYP1A2CYP3A4
SCHEMBL10515607 0.91 CYP1A2 (0.51) CHRM2CHRM4CHRM1CYP1A2CYP3A4
SCHEMBL10522160 0.91 CYP1A2 (0.68) CHRM2CHRM4CHRM1CYP1A2CYP3A4
SCHEMBL10515136 0.90 CHRM2 (0.50) CHRM2CHRM4CHRM1CYP1A2CYP3A4
SCHEMBL9870176 0.87 CHRM2 (0.67) CHRM2CHRM4CHRM1CYP1A2CYP3A4
SCHEMBL9870460 0.86 CHRM2 (0.59) CHRM2CHRM4CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0346744-A1 Condensed diazepinones, process for their preparation and medicaments containing them Dr. Karl Thomae GmbH (DE) 1989-12-20 EP claimed
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
EP-0402734-A2 Composition for the treatment of application of the central nervous system and to enhance cerebral perfusion Dr. Karl Thomae GmbH (DE) 1990-12-19 EP disclosed
EP-0346744-A1 Condensed diazepinones, process for their preparation and medicaments containing them Dr. Karl Thomae GmbH (DE) 1989-12-20 EP disclosed