SCHEMBL6204028

SCHEMBL6204028

CCCCCCCOc1nc(C)c(-c2ccc(OC)cc2Cl)nc1NC

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 14/20 0.48
CNR1 P21554 4/20 0.41
CDC7 O00311 1/20 0.37
DBF4 Q9UBU7 1/20 0.37
PDE2A O00408 1/20 0.35

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
SCHEMBL6201596 1.00 CRHR1 (0.48) CRHR1CNR1CDC7DBF4PDE2A
SCHEMBL6204671 0.99 CRHR1 (0.49) CRHR1CNR1CDC7DBF4
SCHEMBL6203522 0.89 CRHR1 (0.41) CRHR1PDE2A
SCHEMBL6204093 0.89 CRHR1 (0.42) CRHR1CNR1CDC7DBF4
SCHEMBL6201218 0.89 CRHR1 (0.42) CRHR1CNR1CDC7DBF4
SCHEMBL6204600 0.88 CRHR1 (0.46) CRHR1CNR1PDE2A
SCHEMBL6204591 0.88 CRHR1 (0.43) CRHR1CNR1CDC7DBF4
SCHEMBL6203666 0.88 CRHR1 (0.50) CRHR1CNR1
SCHEMBL6204277 0.82 CRHR1 (0.45) CRHR1CNR1
SCHEMBL6203153 0.82 CRHR1 (0.45) CRHR1CNR1

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