SCHEMBL4385064

SCHEMBL4385064

Cn1nc(-c2ccc(OC(C)(C3CCNCC3)C3CC3)cc2)ccc1=O

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 0.66
KCNH2 Q12809 1/20 0.45

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
SCHEMBL1376004 0.80 HRH3 (1.00) HRH3KCNH2
SCHEMBL1373933 0.77 HRH3 (0.69) HRH3KCNH2
SCHEMBL1372662 0.77 HRH3 (0.69) HRH3KCNH2
SCHEMBL1376277 0.74 HRH3 (0.65) HRH3KCNH2
SCHEMBL1372976 0.74 HRH3 (0.65) HRH3KCNH2
SCHEMBL1372729 0.74 HRH3 (0.65) HRH3KCNH2
SCHEMBL1376346 0.72 HRH3 (0.61) HRH3KCNH2
SCHEMBL1376028 0.70 HRH3 (0.58) HRH3KCNH2
SCHEMBL4054814 0.67 HRH3 (0.58) HRH3KCNH2
SCHEMBL11400917 0.67 HRH3 (0.54) HRH3KCNH2

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-2069312-A2 PYRIDIZINONE DERIVATIVES Cephalon, Inc. (US) 2009-06-17 EP disclosed
WO-2008013838-A2 PYRIDIZINONE DERIVATIVES CEPHALON, INC. (US) 2008-01-31 WO disclosed