SCHEMBL7915174

SCHEMBL7915174

CC(C)(CO)N1CCc2nc(OC3CCN(C4CCC4)CC3)ccc2C1=O

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 18/20 0.40
KCNH2 Q12809 4/20 0.39
MAOA P21397 2/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL3372720 0.85 HRH3 (0.39) HRH3KCNH2MAOAMAOB
SCHEMBL3406525 0.83 HRH3 (0.40) HRH3KCNH2MAOAMAOB
SCHEMBL3395406 0.82 HRH3 (0.41) HRH3KCNH2MAOAMAOB
SCHEMBL3402540 0.81 HRH3 (0.47) HRH3KCNH2
SCHEMBL3400944 0.81 HRH3 (0.42) HRH3KCNH2MAOAMAOB
SCHEMBL3372589 0.81 HRH3 (0.43) HRH3KCNH2
SCHEMBL3401992 0.80 HRH3 (0.41) HRH3KCNH2MAOAMAOB
SCHEMBL3401594 0.79 HRH3 (0.48) HRH3KCNH2
SCHEMBL3399689 0.79 HRH3 (0.43) HRH3KCNH2
SCHEMBL3372175 0.79 HRH3 (0.38) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010052222-A1 (DIHYDRO)NAPHTHYRIDINONE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2010-05-14 WO disclosed