SCHEMBL6204481

SCHEMBL6204481

CCc1nc(-c2ccc(C(C)C)cc2OC)c(CC)nc1OCC(C)CC(C)C

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 18/20 0.45
AAK1 Q2M2I8 1/20 0.35
FYN P06241 1/20 0.34

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
SCHEMBL7482395 0.88 CRHR1 (0.56) CRHR1
SCHEMBL6201876 0.85 CRHR1 (0.48) CRHR1AAK1
SCHEMBL6202927 0.84 CRHR1 (0.45) CRHR1FYN
SCHEMBL6203563 0.83 CRHR1 (0.44) CRHR1
SCHEMBL6203954 0.83 CRHR1 (0.44) CRHR1
SCHEMBL5438012 0.83 CRHR1 (0.59) CRHR1
SCHEMBL5434060 0.82 CRHR1 (0.48) CRHR1FYN
SCHEMBL5434698 0.80 CRHR1 (0.50) CRHR1FYN
SCHEMBL5440212 0.79 CRHR1 (0.52) CRHR1
SCHEMBL6199707 0.78 CRHR1 (0.57) 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