SCHEMBL10933422

SCHEMBL10933422

CN1CCC(CC(=O)N2c3ccccc3NC(=O)c3ccccc32)CC1

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 9/20 0.59
CHRM1 P11229 8/20 0.59
CHRM4 P08173 7/20 0.56
CHRM3 P20309 6/20 0.56
USP2 O75604 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
CYP1A2 P05177 1/20 0.53
CHRM5 P08912 1/20 0.53
CYP2D6 P10635 1/20 0.53

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
SCHEMBL11083304 0.88 ALDH1A1 (0.50) CHRM2CHRM1CHRM4CHRM3ALDH1A1
SCHEMBL10874963 0.87 CHRM2 (0.72) CHRM2CHRM1CHRM4CHRM3USP2
SCHEMBL30741224 0.87 CHRM2 (0.47) CHRM2CHRM1CHRM4CHRM3USP2
SCHEMBL6746859 0.87 CHRM2 (0.47) CHRM2CHRM1CHRM4CHRM3USP2
SCHEMBL10935250 0.86 CHRM2 (0.52) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL11078442 0.86 CHRM2 (0.54) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL10932357 0.86 CHRM2 (0.52) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL10932366 0.86 CHRM2 (0.52) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL11084542 0.86 CHRM2 (0.54) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL10931615 0.86 CHRM2 (0.54) CHRM2CHRM1CHRM4CHRM3CHRM5

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
EP-0085892-B1 SUBSTITUTED BENZODIAZEPINONES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM Dr. Karl Thomae GmbH (DE) 1985-12-18 EP disclosed
US-4447434-A ANTIULCER, ANTISECRETORY, OR ANTICHOLINERGIC AGENTS DR. KARL THOMAE GMBH (DE) 1984-05-08 US disclosed
EP-0085892-A1 Substituted benzodiazepinones, process for their preparation and medicines containing them Dr. Karl Thomae GmbH (DE) 1983-08-17 EP disclosed