SCHEMBL4701263

SCHEMBL4701263

Cc1cc(C)c(-c2cccc3c(CCCN(C)c4ccco4)n(C)nc23)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 8/20 0.39
ADORA2A P29274 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
Trifluoroacetic Acid SCHEMBL4697900 0.91 CRHR1 (0.35) CRHR1
SCHEMBL4702330 0.80 CRHR1 (0.41) CRHR1
SCHEMBL4701270 0.79 CHRM2 (0.39) CRHR1
SCHEMBL6025193 0.76 CRHR1 (0.42) CRHR1
Trifluoroacetic Acid SCHEMBL4702931 0.73 CRHR1 (0.36) CRHR1
SCHEMBL3366236 0.72 CRHR1 (0.44) CRHR1
SCHEMBL4702271 0.72 CRHR1 (0.39) CRHR1
SCHEMBL4698855 0.72 CRHR1 (0.44) CRHR1
Hydrochloric Acid SCHEMBL3365029 0.71 CRHR1 (0.43) CRHR1
Hydrochloric Acid SCHEMBL4697950 0.71 CRHR1 (0.44) 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
EP-1569911-B1 INDAZOLE DERIVATIVES AS CRF ANTAGONISTS HOFFMANN LA ROCHE (CH) 2008-07-02 EP claimed