SCHEMBL3369520

SCHEMBL3369520

N#Cc1cc(C#N)c(OC2CCN(C3CCC3)CC2)nc1Cl

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.47
KCNH2 Q12809 4/20 0.39
SGK1 O00141 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ACHE P22303 2/20 0.36
BCHE P06276 1/20 0.36
KDM2B Q8NHM5 1/20 0.35

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
SCHEMBL3369618 0.89 HRH3 (0.44) HRH3KCNH2SGK1
SCHEMBL3369084 0.83 HRH3 (0.43) HRH3KCNH2SGK1KDM2B
SCHEMBL3369567 0.81 HRH3 (0.49) HRH3KCNH2
SCHEMBL1038688 0.79 MAPT (0.43) HRH3SGK1
SCHEMBL3370618 0.77 HRH3 (0.38) HRH3KCNH2SGK1
SCHEMBL3369868 0.75 HRH3 (0.45) HRH3KCNH2
SCHEMBL4229745 0.74 HRH3 (0.60) HRH3KCNH2
SCHEMBL1040150 0.74 MAPT (0.45) HRH3SGK1
SCHEMBL3373065 0.73 HRH3 (0.41) HRH3KCNH2SGK1
SCHEMBL1202695 0.73 HRH3 (0.37) HRH3KCNH2SGK1

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
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