SCHEMBL14049593

SCHEMBL14049593

CON(C)Cc1c2c(nn1C)N(c1c(C)cc(C)cc1C)CCC2

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 13/20 0.32
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
PARP1 P09874 1/20 0.30

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
SCHEMBL5048799 0.81 CRHR1 (0.35) CRHR1
SCHEMBL5043932 0.79 CRHR1 (0.31) CRHR1
SCHEMBL6022724 0.77 CRHR1 (0.32) CRHR1
SCHEMBL5043125 0.76 CRHR1 (0.32) CRHR1
SCHEMBL5043423 0.76 CRHR1 (0.32) CRHR1
SCHEMBL14031202 0.76 PKM (0.36) CRHR1
SCHEMBL5778487 0.75 CRHR1 (0.34) CRHR1
SCHEMBL6022722 0.74 CRHR1 (0.34) CRHR1RXRARXRBRXRG
SCHEMBL5039155 0.74 MAPT (0.34) CRHR1
SCHEMBL5776900 0.74 MEN1 (0.32) CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7432283-B2 Heterocyclic GABAA subtype selective receptor modulators ROCHE PALO ALTO LLC (US) 2008-10-07 US disclosed