SCHEMBL6204414

SCHEMBL6204414

CCCCCCOc1nc(CC)c(-c2ccc(C(C)C)nc2OC)nc1CC

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 17/20 0.42
SOAT1 P35610 1/20 0.32
FAAH O00519 1/20 0.31
MGLL Q99685 1/20 0.31

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
SCHEMBL6203742 0.99 CRHR1 (0.42) CRHR1
SCHEMBL6200455 0.87 CRHR1 (0.41) CRHR1
SCHEMBL6203669 0.83 CRHR1 (0.56) CRHR1SOAT1
SCHEMBL5438838 0.80 CRHR1 (0.57) CRHR1
SCHEMBL6203954 0.80 CRHR1 (0.44) CRHR1
SCHEMBL6202927 0.79 CRHR1 (0.45) CRHR1
SCHEMBL6203029 0.79 CRHR1 (0.46) CRHR1
SCHEMBL7475717 0.75 CRHR1 (0.60) CRHR1
SCHEMBL6201091 0.74 CRHR1 (0.43) CRHR1
SCHEMBL7478531 0.74 TLR8 (0.44) 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