SCHEMBL27501034

SCHEMBL27501034

CCc1nc(-c2ccc(Cl)cc2C)c(CC)nc1NC(C)CC

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 20/20 0.65

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
SCHEMBL6074971 0.89 CRHR1 (0.80) CRHR1
SCHEMBL6080630 0.89 CRHR1 (0.80) CRHR1
SCHEMBL5411684 0.79 CRHR1 (1.00) CRHR1
SCHEMBL6074947 0.78 CRHR1 (0.67) CRHR1
SCHEMBL5419532 0.78 CRHR1 (0.81) CRHR1
SCHEMBL7474934 0.77 CRHR1 (0.50) CRHR1
SCHEMBL5410054 0.77 CRHR1 (0.82) CRHR1
SCHEMBL5412960 0.76 CRHR1 (0.74) CRHR1
SCHEMBL5427390 0.74 CRHR1 (0.47) CRHR1
SCHEMBL6075389 0.74 CRHR1 (0.61) 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
CN-1231473-C Substituted arylpyrazines NEUROGEN CORP (US) 2005-12-14 CN disclosed
CN-1400970-A Substituted arylpyrazines NEUROGEN CORP (US) 2003-03-05 CN disclosed