SCHEMBL6201406

SCHEMBL6201406

CCCCCCCOc1nc(C)c(-c2ccc(C(C)C)cc2OC)nc1NC

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 9/20 0.41
CASR P41180 1/20 0.33
FYN P06241 1/20 0.33
SMPD1 P17405 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
SCHEMBL6201580 0.99 CRHR1 (0.41) CRHR1CASRFYN
SCHEMBL6201837 0.89 CRHR1 (0.33) CRHR1CASRFYNSMPD1C5
SCHEMBL6203238 0.89 CRHR1 (0.33) CRHR1CASRFYNSMPD1C5
SCHEMBL5443557 0.89 CRHR1 (0.44) CRHR1FYN
SCHEMBL6205678 0.88 CRHR1 (0.34) CRHR1CASRFYNSMPD1
SCHEMBL6204658 0.86 CRHR1 (0.46) CRHR1
SCHEMBL6203571 0.86 CRHR1 (0.46) CRHR1
SCHEMBL6203227 0.85 CRHR1 (0.47) CRHR1
SCHEMBL6204277 0.85 CRHR1 (0.45) CRHR1
SCHEMBL6203153 0.85 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