SCHEMBL7472347

SCHEMBL7472347

CCCCCOc1nc(C)c(-c2ccc(Cl)cc2Cl)nc1C

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 13/20 0.51
CNR1 P21554 6/20 0.50

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
SCHEMBL7479299 0.79 CRHR1 (0.65) CRHR1CNR1
SCHEMBL5414792 0.78 CRHR1 (0.64) CRHR1
SCHEMBL7219581 0.75 CRHR1 (0.45) CRHR1CNR1
SCHEMBL6204671 0.75 CRHR1 (0.49) CRHR1CNR1
SCHEMBL6201596 0.74 CRHR1 (0.48) CRHR1CNR1
SCHEMBL6204028 0.74 CRHR1 (0.48) CRHR1CNR1
SCHEMBL6099734 0.73 CRHR1 (0.49) CRHR1CNR1
SCHEMBL6204600 0.72 CRHR1 (0.46) CRHR1CNR1
SCHEMBL5410149 0.72 CRHR1 (0.49) CRHR1CNR1
SCHEMBL5411875 0.72 CRHR1 (0.49) CRHR1CNR1

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-1255740-A2 SUBSTITUTED ARYLPYRAZINES NEUROGEN CORPORATION (US) 2002-11-13 EP claimed
WO-2001060806-A2 SUBSTITUTED ARYLPYRAZINES NEUROGEN CORPORATION (US) 2001-08-23 WO claimed