SCHEMBL6204600

SCHEMBL6204600

CCCCCOc1nc(C)c(-c2ccc(OC(C)C)cc2Cl)nc1NC

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 12/20 0.46
CNR1 P21554 5/20 0.41
LIMK1 P53667 1/20 0.37
LIMK2 P53671 1/20 0.37
PPARG P37231 1/20 0.34
PDE2A O00408 1/20 0.33

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
SCHEMBL6204648 0.90 PTPN11 (0.35) CRHR1CNR1PDE2A
SCHEMBL6203274 0.89 CNR1 (0.40) CRHR1CNR1LIMK1LIMK2PPARG
SCHEMBL6204671 0.89 CRHR1 (0.49) CRHR1CNR1
SCHEMBL6201596 0.88 CRHR1 (0.48) CRHR1CNR1PDE2A
SCHEMBL6204028 0.88 CRHR1 (0.48) CRHR1CNR1PDE2A
SCHEMBL6203227 0.87 CRHR1 (0.47) CRHR1
SCHEMBL6203571 0.86 CRHR1 (0.46) CRHR1
SCHEMBL6204658 0.86 CRHR1 (0.46) CRHR1
SCHEMBL5432592 0.85 CRHR1 (0.50) CRHR1LIMK1LIMK2
SCHEMBL6201148 0.78 CRHR1 (0.48) CRHR1PDE2A

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