SCHEMBL4066308

SCHEMBL4066308

O=c1ccc(-c2ccc(OCCCC3CCCNC3)cc2)nn1CC(F)(F)F

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.60
KCNH2 Q12809 1/20 0.41
ACP1 P24666 2/20 0.38
NPY1R P25929 6/20 0.38

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
SCHEMBL4054814 0.84 HRH3 (0.58) HRH3KCNH2
SCHEMBL4060149 0.81 HRH3 (0.59) HRH3KCNH2ACP1
SCHEMBL4373449 0.77 HRH3 (0.61) HRH3ACP1NPY1R
SCHEMBL4057147 0.76 HRH3 (0.56) HRH3KCNH2ACP1NPY1R
SCHEMBL4056938 0.76 HRH3 (0.44) HRH3KCNH2ACP1NPY1R
SCHEMBL1373694 0.75 HRH3 (0.69) HRH3KCNH2
SCHEMBL1374216 0.75 HRH3 (1.00) HRH3KCNH2
SCHEMBL4065549 0.74 HRH3 (0.49) HRH3ACP1NPY1R
SCHEMBL4055751 0.73 HRH3 (0.46) HRH3KCNH2ACP1NPY1R
SCHEMBL3407020 0.73 NPY1R (0.44) ACP1NPY1R

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 4 patents. claimed = in the patent's claims; disclosed = body only.

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