SCHEMBL6203243

SCHEMBL6203243

CCCCCOc1nc(Br)c(-c2ccc(OC(F)(F)F)cc2OC)nc1NC

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 9/20 0.48
SCN9A Q15858 1/20 0.37
RUNX1 Q01196 1/20 0.35
NR1I2 O75469 1/20 0.33
GRM7 Q14831 1/20 0.33
CTSA P10619 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
SCHEMBL6202901 0.99 CRHR1 (0.47) CRHR1SCN9ARUNX1NR1I2GRM7
SCHEMBL6204110 0.90 CRHR1 (0.58) CRHR1SCN9ARUNX1NR1I2GRM7
SCHEMBL6202563 0.89 CRHR1 (0.57) CRHR1SCN9ARUNX1NR1I2
SCHEMBL6203296 0.89 CRHR1 (0.57) CRHR1SCN9ARUNX1NR1I2
SCHEMBL6203200 0.89 CRHR1 (0.43) CRHR1
SCHEMBL6203602 0.88 CRHR1 (0.45) CRHR1
SCHEMBL6203198 0.88 CRHR1 (0.42) CRHR1
SCHEMBL6204985 0.87 CRHR1 (0.44) CRHR1
SCHEMBL6202389 0.87 CRHR1 (0.44) CRHR1
SCHEMBL6203030 0.87 CRHR1 (0.46) CRHR1SCN9A

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