SCHEMBL6167869

SCHEMBL6167869

CCc1nc(-c2cc3c(cc2OC)CCCC3)c(CC)nc1NC(CC)c1cccc(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 20/20 0.55

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
SCHEMBL6172799 0.90 CRHR1 (0.50) CRHR1
SCHEMBL6168946 0.87 CRHR1 (0.46) CRHR1
SCHEMBL6347154 0.83 CRHR1 (0.48) CRHR1
SCHEMBL6346265 0.83 CRHR1 (0.48) CRHR1
SCHEMBL6168450 0.83 CRHR1 (0.45) CRHR1
SCHEMBL6167872 0.83 CRHR1 (0.45) CRHR1
SCHEMBL6174523 0.82 CRHR1 (0.46) CRHR1
SCHEMBL6166200 0.82 CRHR1 (0.65) CRHR1
SCHEMBL6344334 0.81 CRHR1 (0.53) CRHR1
SCHEMBL6345679 0.81 CRHR1 (0.53) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1499599-A1 SUBSTITUTED PYRAZINE DERIVATIVES Pharmacia & Upjohn Company LLC (US) 2005-01-26 EP claimed
WO-2003091225-A1 SUBSTITUTED PYRAZINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-11-06 WO claimed
EP-1499599-A1 SUBSTITUTED PYRAZINE DERIVATIVES Pharmacia & Upjohn Company LLC (US) 2005-01-26 EP disclosed
WO-2003091225-A1 SUBSTITUTED PYRAZINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-11-06 WO disclosed