SCHEMBL3372912

SCHEMBL3372912

CCN1CCc2nc(OC3CCN(C(C)C)CC3)ccc2C1=O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 16/20 0.43
CYP2D6 P10635 2/20 0.38
CYP3A4 P08684 1/20 0.38
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 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
SCHEMBL3397891 0.88 PRMT5 (0.44) PRMT5WDR77
SCHEMBL3372589 0.84 HRH3 (0.43) HRH3
SCHEMBL3369747 0.84 GRM5 (0.41) HRH3PRMT5WDR77
SCHEMBL3399689 0.84 HRH3 (0.43) HRH3
SCHEMBL3402918 0.83 HRH3 (0.42) HRH3
SCHEMBL3399164 0.82 GABRG2 (0.40) HRH3PRMT5WDR77
SCHEMBL3369487 0.82 HTR1A (0.39) HRH3CYP2D6CYP3A4
SCHEMBL3370584 0.80 HRH3 (0.41) HRH3PRMT5WDR77
SCHEMBL3370842 0.80 HRH3 (0.41) HRH3PRMT5WDR77
SCHEMBL3398980 0.80 HRH3 (0.41) HRH3PRMT5WDR77

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