SCHEMBL3370860

SCHEMBL3370860

CCN1CCc2cc(OC3CCN(C4CCC4)CC3)ncc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 16/20 0.47
KCNH2 Q12809 3/20 0.43
HTR1A P08908 2/20 0.40
DRD2 P14416 2/20 0.40
HTR2A P28223 2/20 0.40
MAOA P21397 1/20 0.39
CYP2D6 P10635 1/20 0.39
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 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
SCHEMBL3372205 0.80 HRH3 (0.39) HRH3KCNH2HTR1ADRD2HTR2A
SCHEMBL3396694 0.78 HRH3 (0.43) HRH3KCNH2HTR1ADRD2HTR2A
SCHEMBL3368822 0.78 HTR1A (0.39) HRH3KCNH2HTR1ADRD2HTR2A
SCHEMBL3372589 0.78 HRH3 (0.43) HRH3KCNH2
SCHEMBL3399689 0.76 HRH3 (0.43) HRH3KCNH2
SCHEMBL3402918 0.75 HRH3 (0.42) HRH3KCNH2
SCHEMBL3403197 0.73 HRH3 (0.42) HRH3KCNH2
SCHEMBL3400879 0.72 HRH3 (0.41) HRH3KCNH2MAOAPRMT5WDR77
SCHEMBL3370842 0.72 HRH3 (0.41) HRH3KCNH2MAOAPRMT5WDR77
SCHEMBL3373696 0.71 HRH3 (0.39) 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 3 patents. 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 claimed
WO-2010052222-A1 (DIHYDRO)NAPHTHYRIDINONE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2010-05-14 WO disclosed
WO-2010052222-A1 (DIHYDRO)NAPHTHYRIDINONE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2010-05-14 WO disclosed