SCHEMBL13616928

SCHEMBL13616928

CCc1nc(-c2ccc(O)cc2Cl)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1OC(=O)CNC

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 20/20 0.47

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
SCHEMBL3840945 0.93 CRHR1 (0.49) CRHR1
SCHEMBL3840943 0.93 CRHR1 (0.49) CRHR1
SCHEMBL3838635 0.91 CRHR1 (0.46) CRHR1
SCHEMBL3838636 0.91 CRHR1 (0.46) CRHR1
SCHEMBL13616683 0.91 CRHR1 (0.48) CRHR1
SCHEMBL3843437 0.85 CRHR1 (0.50) CRHR1
SCHEMBL3843441 0.85 CRHR1 (0.50) CRHR1
SCHEMBL3843442 0.85 CRHR1 (0.50) CRHR1
SCHEMBL3845886 0.84 CRHR1 (0.51) CRHR1
SCHEMBL3845881 0.84 CRHR1 (0.51) 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-1446387-B1 SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES PHARMACIA & UPJOHN CO LLC (US) 2009-11-04 EP disclosed