SCHEMBL9825152

SCHEMBL9825152

CCN(CC)CCCCC1CCCN(CCN)C1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCHE P06276 5/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SIGMAR1 Q99720 2/20 0.34
BACE1 P56817 1/20 0.32
LSS P48449 2/20 0.32
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
CARM1 Q86X55 1/20 0.31
PRMT6 Q96LA8 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL9824839 0.86 SIGMAR1 (0.50) BCHESIGMAR1BACE1CARM1PRMT6
SCHEMBL9824411 0.82 GNAO1 (0.43) BCHESIGMAR1LSSGNAI3GNAO1
SCHEMBL9824779 0.81 KMT2A (0.46) BCHEMEN1KMT2ACARM1PRMT6
SCHEMBL20284250 0.80 SIGMAR1 (0.38) SIGMAR1LSSCHRM2CHRM4CHRM1
SCHEMBL9824437 0.80 MAOB (0.34) BCHEMEN1KMT2ASIGMAR1LSS
SCHEMBL9825032 0.79 HRH3 (0.41) BCHESIGMAR1BACE1HRH3
SCHEMBL9824777 0.78 GNAO1 (0.44) GNAI3GNAO1GNAI1CHRM2CHRM4
SCHEMBL11615967 0.77 ALOX15 (0.41) BCHESIGMAR1CARM1PRMT6
SCHEMBL9824888 0.76 HRH3 (0.41) SIGMAR1BACE1HRH3
SCHEMBL9823964 0.75 MEN1 (0.39) BCHEMEN1KMT2ABACE1GNAI3

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-0273239-B1 CONDENSED DIAZEPINONES, PROCESSES FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Dr. Karl Thomae GmbH (DE) 1991-03-06 EP disclosed
US-4873236-A BRADYCARDIAL AGENTS DR. KARL THOMAE GMBH (DE) 1989-10-10 US disclosed
EP-0273239-A1 Condensed diazepinones, processes for their preparation and medicaments containing them Dr. Karl Thomae GmbH (DE) 1988-07-06 EP disclosed