SCHEMBL14049595

SCHEMBL14049595

Cc1cc(C)c(N2CCCc3c2nn(C)c3O)c(Cl)c1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
CRHR1 P34998 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
SCHEMBL14049594 0.91 MAPT (0.33) RXRARXRBRXRGCRHR1
SCHEMBL14031211 0.87 PKM (0.33) RXRARXRBRXRGCRHR1
SCHEMBL5046718 0.86 RXRA (0.31) RXRARXRBRXRG
SCHEMBL14049519 0.85 RXRA (0.30) RXRARXRBRXRG
SCHEMBL5043792 0.85 RXRA (0.30) RXRARXRBRXRG
SCHEMBL5039390 0.83 POLB (0.43) RXRARXRBRXRGCRHR1
SCHEMBL14049522 0.82 RXRA (0.33) RXRARXRBRXRGCRHR1
SCHEMBL5044714 0.80 RXRA (0.33) RXRARXRBRXRGCRHR1
SCHEMBL5039393 0.79 CRHR1 (0.32) CRHR1
SCHEMBL5039764 0.79 CRHR1 (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