SCHEMBL6202560

SCHEMBL6202560

CCCCCNc1nc(CC)c(-c2ccc(N(C)C)nc2CC)nc1OC

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 16/20 0.42
TLR8 Q9NR97 3/20 0.38
TLR7 Q9NYK1 2/20 0.38
DNM2 P50570 1/20 0.37

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
SCHEMBL6203769 0.91 CRHR1 (0.39) CRHR1TLR8TLR7DNM2
SCHEMBL7474850 0.81 CRHR1 (0.46) CRHR1TLR8TLR7
SCHEMBL6204988 0.81 CRHR1 (0.60) CRHR1TLR8TLR7
SCHEMBL5439524 0.80 CRHR1 (0.62) CRHR1
SCHEMBL7482439 0.79 CRHR1 (0.53) CRHR1
SCHEMBL7606978 0.79 CRHR1 (0.59) CRHR1
SCHEMBL6203029 0.78 CRHR1 (0.46) CRHR1TLR8TLR7
SCHEMBL7479379 0.78 CRHR1 (0.57) CRHR1
SCHEMBL6202370 0.78 CRHR1 (0.51) CRHR1
SCHEMBL7477527 0.77 CRHR1 (0.48) CRHR1TLR8TLR7

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