SCHEMBL6187544

SCHEMBL6187544

CCc1nc(NC2c3ccccc3CC2O)c(CC)nc1Nc1ccc(C)cc1

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 20/20 0.48

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
SCHEMBL13617168 0.85 CRHR1 (0.49) CRHR1
SCHEMBL3843531 0.82 CRHR1 (0.46) CRHR1
SCHEMBL6649037 0.82 CRHR1 (0.46) CRHR1
SCHEMBL3845342 0.82 CRHR1 (0.46) CRHR1
SCHEMBL6092163 0.82 CRHR1 (0.46) CRHR1
SCHEMBL4960335 0.82 CRHR1 (0.46) CRHR1
SCHEMBL3839119 0.81 CRHR1 (0.46) CRHR1
SCHEMBL3842329 0.81 CRHR1 (0.46) CRHR1
SCHEMBL6643610 0.80 CRHR1 (0.46) CRHR1
SCHEMBL3842234 0.80 CRHR1 (0.46) 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
US-20040116444-A1 Substituted 1,4-pyrazine derivatives PHARMACIA & UPJOHN COMPANY 2004-06-17 US claimed
EP-1539736-A1 SUBSTITUTED 1,4-PYRAZINE DERIVATIVES Pharmacia & Upjohn Company LLC (US) 2005-06-15 EP disclosed
US-20040116444-A1 Substituted 1,4-pyrazine derivatives PHARMACIA & UPJOHN COMPANY 2004-06-17 US disclosed
WO-2004024719-A1 SUBSTITUTED 1,4-PYRAZINE DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-25 WO disclosed