SCHEMBL6201837

SCHEMBL6201837

CCCCCCOc1nc(Br)c(-c2ccc(C(C)C)cc2OC)nc1NC

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 7/20 0.33
SMPD1 P17405 4/20 0.33
CASR P41180 1/20 0.33
FYN P06241 1/20 0.33
C5 P01031 1/20 0.32

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
SCHEMBL6203238 1.00 CRHR1 (0.33) CRHR1SMPD1CASRFYNC5
SCHEMBL6205678 0.99 CRHR1 (0.34) CRHR1SMPD1CASRFYN
SCHEMBL6201406 0.89 CRHR1 (0.41) CRHR1SMPD1CASRFYNC5
SCHEMBL6201580 0.88 CRHR1 (0.41) CRHR1CASRFYN
SCHEMBL6202607 0.87 CRHR1 (0.46) CRHR1SMPD1
SCHEMBL6204280 0.87 CRHR1 (0.46) CRHR1SMPD1
SCHEMBL6203048 0.85 CRHR1 (0.46) CRHR1SMPD1
SCHEMBL6202389 0.85 CRHR1 (0.44) CRHR1SMPD1
SCHEMBL6204985 0.85 CRHR1 (0.44) CRHR1SMPD1
SCHEMBL6203602 0.84 CRHR1 (0.45) 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
EP-1554258-A1 5-SUBSTITUTED-2-ARYLPYRAZINES AS MODULATORS OF CRF RECEPTORS NEUROGEN CORPORATION (US) 2005-07-20 EP claimed
WO-2004018437-A1 5-SUBSTITUTED-2-ARYLPYRAZINES AS MODULATORS OF CRF RECEPTORS NEUROGEN CORPORATION (US) 2004-03-04 WO claimed