SCHEMBL28192531

SCHEMBL28192531

CC1C=CN(c2ccccc2)N1Cl

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.31
GAA P10253 1/20 0.31
G6PD P11413 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LOX P28300 1/20 0.30
LOXL3 P58215 1/20 0.30
LOXL4 Q96JB6 1/20 0.30
LOXL2 Q9Y4K0 1/20 0.30

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
SCHEMBL28858304 0.79 LOX (0.35) MAOAGAAG6PDL3MBTL1LOX
SCHEMBL21485070 0.64 MAPK1 (0.33) LOXLOXL3LOXL4LOXL2
SCHEMBL2518889 0.60 KMT2A (0.36) MAOAGAAG6PDL3MBTL1LOX
SCHEMBL2517230 0.60 ALDH1A1 (0.37) GAA
SCHEMBL4989924 0.60 SIGMAR1 (0.40) GAAL3MBTL1
SCHEMBL12170156 0.60 MAOA (0.41) MAOAGAAG6PDL3MBTL1LOX
SCHEMBL28876828 0.58 MEN1 (0.35) GAAG6PD
SCHEMBL979712 0.58 L3MBTL1 (0.39) MAOAGAAG6PDL3MBTL1LOX
SCHEMBL28902166 0.58 L3MBTL1 (0.39) MAOAGAAG6PDL3MBTL1LOX
SCHEMBL12254378 0.58 MAPK1 (0.49) GAAG6PDL3MBTL1

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
CN-107556344-A Organic electroluminescent material and device 环球展览公司 2018-01-09 CN disclosed