SCHEMBL2929183

SCHEMBL2929183

CCCNCCN(CCC)c1nc(C(F)(F)F)c(-c2c(C)nn3c(C(CC)CC)cc(C)nc23)s1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 20/20 0.38

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
SCHEMBL2933140 0.83 CRHR1 (0.38) CRHR1
SCHEMBL2498882 0.78 POLB (0.39) CRHR1
SCHEMBL2929947 0.78 CYP1A2 (0.34) CRHR1
SCHEMBL2495462 0.78 KDM4E (0.38) CRHR1
SCHEMBL2495432 0.75 POLB (0.40) CRHR1
SCHEMBL2931328 0.74 PIK3CG (0.38)
SCHEMBL2493432 0.74 CYP1A2 (0.37) CRHR1
SCHEMBL2932900 0.72 CRHR1 (0.47) CRHR1
SCHEMBL2930712 0.71 CRHR1 (0.39) CRHR1
SCHEMBL2498943 0.70 BRD4 (0.34)

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-2094709-B1 THIAZOLE PYRAZOLOPYRIMIDINES AS CRF1 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2010-09-15 EP disclosed