SCHEMBL17309174

SCHEMBL17309174

c1ccc(-c2ccc(C3=NC(c4ccccc4)C3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.49
MAOA P21397 5/20 0.49
TAAR1 Q96RJ0 2/20 0.47
NOS3 P29474 4/20 0.44
KDM1A O60341 3/20 0.44
NOS2 P35228 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL5889312 0.78 NOS1 (0.49) MAOBMAOATAAR1NOS3NOS2
SCHEMBL18698103 0.77 MAOB (0.44) MAOBMAOATAAR1NOS3NOS2
SCHEMBL16866988 0.76 MAOB (0.42) MAOBMAOATAAR1NOS3NOS2
SCHEMBL5889295 0.75 NOS1 (0.54) MAOBMAOATAAR1NOS3NOS2
SCHEMBL19563191 0.73 MAOB (0.47) MAOBMAOATAAR1MEN1KMT2A
SCHEMBL20861080 0.73 MAOB (0.47) MAOBMAOATAAR1MEN1KMT2A
SCHEMBL14528195 0.73 MAOB (0.43) MAOBMAOATAAR1KDM1AMEN1
SCHEMBL9485190 0.73 MAOB (0.43) MAOBMAOATAAR1NOS3MEN1
SCHEMBL28928295 0.73 MEN1 (0.43) MAOBMAOAKDM1AMEN1KMT2A
SCHEMBL23419435 0.72 MAOB (0.44) MAOBMAOATAAR1NOS3GAA

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
EP-2249410-B1 ORGANIC ELECTROLUMINESCENT ELEMENT, AND MANUFACTURING METHOD AND USES THEREFOR SAMSUNG ELECTRONICS CO LTD (KR) 2015-12-02 EP disclosed