SCHEMBL9825562

SCHEMBL9825562

CCN(CC)CCC1CCN(CCN)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 4/20 0.43
GNAI3 P08754 3/20 0.43
GNAI1 P63096 3/20 0.43
CARM1 Q86X55 2/20 0.41
PRMT6 Q96LA8 2/20 0.41
PRMT3 O60678 1/20 0.41
PRMT1 Q99873 1/20 0.41
PRMT8 Q9NR22 1/20 0.41
ALOX15 P16050 1/20 0.40
ACHE P22303 3/20 0.38
NCF1 P14598 1/20 0.34
CHRM1 P11229 1/20 0.32
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
SCHEMBL9824777 0.90 GNAO1 (0.44) GNAO1GNAI3GNAI1CARM1PRMT6
SCHEMBL9824411 0.89 GNAO1 (0.43) GNAO1GNAI3GNAI1CARM1PRMT6
SCHEMBL22824381 0.86 GNAO1 (0.41) GNAO1ACHEHRH3
SCHEMBL9824832 0.82 GNAO1 (0.45) GNAO1GNAI3GNAI1CARM1PRMT6
SCHEMBL24207822 0.80 GNAO1 (0.53) GNAO1GNAI3GNAI1CARM1PRMT6
SCHEMBL12440507 0.80 NCF1 (0.45) GNAO1GNAI3GNAI1ACHENCF1
SCHEMBL9823958 0.79 GNAO1 (0.47) GNAO1GNAI3GNAI1CARM1PRMT6
SCHEMBL9824478 0.78 GNAO1 (0.46) GNAO1GNAI3GNAI1CARM1PRMT6
SCHEMBL11410375 0.77 ALOX15 (0.55) GNAO1GNAI3GNAI1CARM1PRMT6
SCHEMBL598617 0.77 GNAO1 (0.58) GNAO1GNAI3GNAI1CARM1PRMT6

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