SCHEMBL7111027

SCHEMBL7111027

Cc1cc(-n2ccc(-c3nccs3)n2)c(C(C)O)c(Cl)n1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 19/20 0.48
PDE10A Q9Y233 1/20 0.39

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
SCHEMBL3238577 0.82 CRHR1 (0.48) CRHR1PDE10A
SCHEMBL5252287 0.80 CRHR1 (0.47) CRHR1PDE10A
SCHEMBL3242067 0.80 CRHR1 (0.48) CRHR1PDE10A
SCHEMBL3247778 0.79 CRHR1 (0.47) CRHR1PDE10A
SCHEMBL5549998 0.78 CRHR1 (0.47) CRHR1PDE10A
SCHEMBL5551936 0.77 CRHR1 (0.52) CRHR1PDE10A
Hydrochloric Acid SCHEMBL6283880 0.77 CRHR1 (0.47) CRHR1PDE10A
SCHEMBL3244939 0.77 CRHR1 (0.47) CRHR1PDE10A
SCHEMBL3242643 0.77 CRHR1 (0.49) CRHR1
SCHEMBL3246209 0.76 CRHR1 (0.50) CRHR1PDE10A

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-1425280-A2 HETERO-BICYCLIC CRF ANTAGONISTS GLAXO GROUP LIMITED (GB) 2004-06-09 EP disclosed
WO-2003008412-A2 HETERO-BICYCLIC CRF ANTAGONISTS GLAXO GROUP LIMITED (GB) 2003-01-30 WO disclosed