SCHEMBL9214779

SCHEMBL9214779

OC(CCc1cccc2ccccc12)CN1CCCCC(CN2CCc3cc4c(cc3C2)OCO4)C1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 10/20 0.43
WDR77 Q9BQA1 10/20 0.43
ABCB1 P08183 4/20 0.38
SIGMAR1 Q99720 2/20 0.37

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 SCHEMBL9208073 0.90 PRMT5 (0.40) PRMT5WDR77SIGMAR1
SCHEMBL9214969 0.89 PRMT5 (0.43) PRMT5WDR77ABCB1SIGMAR1
SCHEMBL9213097 0.87 PDE4B (0.43) PRMT5WDR77ABCB1
SCHEMBL9214560 0.83 PRMT5 (0.43) PRMT5WDR77
SCHEMBL9214376 0.80 KDM4E (0.40) PRMT5WDR77
Hydrochloric Acid SCHEMBL9214826 0.80 PRMT5 (0.39) PRMT5WDR77SIGMAR1
SCHEMBL9215026 0.78 MEN1 (0.43) ABCB1SIGMAR1
SCHEMBL9212338 0.78 RAB9A (0.40) PRMT5WDR77SIGMAR1
SCHEMBL9213257 0.78 PRMT5 (0.42) PRMT5WDR77
SCHEMBL9739331 0.76 MEN1 (0.47) SIGMAR1

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-0292840-B1 Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation THOMAE GMBH DR K (DE) 1995-08-09 EP disclosed
US-5175157-A Cardiovascular disorders BOEHRINGER INGELHEIM GMBH (DE) 1992-12-29 US disclosed
EP-0292840-A2 Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation Dr. Karl Thomae GmbH (DE) 1988-11-30 EP disclosed