SCHEMBL6203432

SCHEMBL6203432

CCCCCOc1nc(C)c(-c2ccc(C(F)(F)F)cc2OC)nc1Cl

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 6/20 0.53
SCN9A Q15858 10/20 0.40
PDE2A O00408 2/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
SPR P35270 1/20 0.37
MBOAT4 Q96T53 1/20 0.36

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
SCHEMBL6203641 0.86 CRHR1 (0.56) CRHR1SCN9APDE2ACNR1CNR2
SCHEMBL6205729 0.86 CRHR1 (0.55) CRHR1SCN9APDE2A
SCHEMBL6204123 0.85 CRHR1 (0.56) CRHR1SCN9APDE2ACNR1CNR2
SCHEMBL6202311 0.85 CRHR1 (0.56) CRHR1SCN9APDE2ACNR1CNR2
SCHEMBL5437714 0.83 CRHR1 (0.60) CRHR1SCN9A
SCHEMBL6204281 0.82 CRHR1 (0.38) CRHR1
SCHEMBL6204876 0.81 CRHR1 (0.50) CRHR1SCN9APDE2ACNR1CNR2
SCHEMBL6203030 0.75 CRHR1 (0.46) CRHR1SCN9ASPR
SCHEMBL6202172 0.74 CRHR1 (0.46) CRHR1SCN9ACNR1CNR2SPR
SCHEMBL6202949 0.74 CRHR1 (0.46) CRHR1SCN9ACNR1CNR2SPR

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