SCHEMBL18850232

SCHEMBL18850232

O=C1CCc2ccc(OCCCCOS)cc2N1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOB P27338 18/20 0.70
MAOA P21397 17/20 0.67
DRD2 P14416 1/20 0.58

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
SCHEMBL2842062 0.93 MAOB (0.80) MAOBMAOADRD2
SCHEMBL29545160 0.87 MAOB (0.72) MAOBMAOA
SCHEMBL29935397 0.87 MAOB (0.72) MAOBMAOADRD2
SCHEMBL28843241 0.87 MAOB (0.72) MAOBMAOADRD2
SCHEMBL8212260 0.87 MAOB (0.72) MAOBMAOADRD2
SCHEMBL238817 0.87 MAOB (0.72) MAOBMAOA
SCHEMBL12880829 0.86 MAOB (0.75) MAOBMAOADRD2
SCHEMBL29460203 0.86 MAOB (0.71) MAOBMAOA
SCHEMBL8513 0.86 MAOB (0.71) MAOBMAOA
SCHEMBL18825568 0.86 MAOB (0.70) MAOBMAOADRD2

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-2017078621-A1 PROCESSES FOR PREPARING BREXPIPRAZOLE SCINOPHARM TAIWAN, LTD. (TW) 2017-05-11 WO disclosed