SCHEMBL3362854

SCHEMBL3362854

CCC(Cc1c2cccc(-c3ccc(Cl)cc3Cl)c2nn1C)NCC1CC1

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 17/20 0.44

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
SCHEMBL4700571 0.84 CRHR1 (0.45) CRHR1
SCHEMBL4700546 0.81 CRHR1 (0.43) CRHR1
SCHEMBL4700572 0.80 CRHR1 (0.41) CRHR1
SCHEMBL3362850 0.77 CRHR1 (0.41) CRHR1
SCHEMBL3839128 0.76 CRHR1 (0.51) CRHR1
SCHEMBL3362846 0.76 CRHR1 (0.55) CRHR1
SCHEMBL3364388 0.75 CRHR1 (0.48) CRHR1
SCHEMBL13538501 0.75 CHRM1 (0.42) CRHR1
SCHEMBL3364753 0.75 CRHR1 (0.50) CRHR1
SCHEMBL3364574 0.75 CRHR1 (0.50) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1656353-B1 GABANERGIC MODULATORS HOFFMANN LA ROCHE (CH) 2010-01-27 EP claimed
EP-1569911-B1 INDAZOLE DERIVATIVES AS CRF ANTAGONISTS HOFFMANN LA ROCHE (CH) 2008-07-02 EP claimed