SCHEMBL15601751

SCHEMBL15601751

O=C1CCc2ccc(OCCCCN3CCc4n[nH]cc4C3)cc2N1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOA P21397 19/20 0.72
MAOB P27338 19/20 0.72
DRD2 P14416 1/20 0.60

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
SCHEMBL15545027 0.86 MAOA (0.71) MAOAMAOBDRD2
SCHEMBL15546287 0.85 MAOA (0.71) MAOAMAOBDRD2
SCHEMBL15544482 0.85 MAOA (0.69) MAOAMAOBDRD2
SCHEMBL15601712 0.84 MAOA (1.00) MAOAMAOBDRD2
SCHEMBL20078437 0.83 MAOA (0.98) MAOAMAOBDRD2
SCHEMBL15545890 0.83 MAOA (0.67) MAOAMAOBDRD2
SCHEMBL15601673 0.82 MAOA (0.66) MAOAMAOBDRD2
SCHEMBL25570556 0.82 MAOA (0.83) MAOAMAOBDRD2
SCHEMBL15545196 0.82 MAOA (0.70) MAOAMAOBDRD2
SCHEMBL15601727 0.82 MAOA (0.71) MAOAMAOBDRD2

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-2013169964-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2013-11-14 WO disclosed