SCHEMBL23448233

SCHEMBL23448233

c1ccc(N(c2ccc(-c3cc4ccccc4c4ccccc34)cc2)c2cccc3c2oc2ccccc23)c(-c2cccc3ccccc23)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.40
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
ALDH1A1 P00352 4/20 0.33
HSD17B10 Q99714 3/20 0.33
HPGD P15428 3/20 0.33
KDM4E B2RXH2 3/20 0.33
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
GPR84 Q9NQS5 2/20 0.32
PRKDC P78527 3/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
HIF1A Q16665 1/20 0.31
GGPS1 O95749 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL23447928 0.96 ALOX5 (0.40) ALOX5MAOAMAOBALDH1A1HSD17B10
SCHEMBL23258296 0.94 ALOX5 (0.39) ALOX5MAOAMAOBALDH1A1HSD17B10
SCHEMBL23447701 0.93 ALOX5 (0.45) ALOX5MAOAMAOBALDH1A1HSD17B10
SCHEMBL23448185 0.93 ALOX5 (0.45) ALOX5MAOAMAOBALDH1A1HSD17B10
SCHEMBL23258131 0.93 ALOX5 (0.41) ALOX5MAOAMAOBALDH1A1HSD17B10
SCHEMBL23258297 0.93 ALOX5 (0.42) ALOX5MAOBALDH1A1HSD17B10HPGD
SCHEMBL23238135 0.93 ALOX5 (0.40) ALOX5ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL23258756 0.92 ALOX5 (0.41) ALOX5MAOAMAOBALDH1A1HSD17B10
SCHEMBL23258070 0.92 ALOX5 (0.41) ALOX5MAOAMAOBALDH1A1HSD17B10
SCHEMBL23258032 0.91 ALOX5 (0.42) ALOX5MAOBALDH1A1HSD17B10HPGD

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-2021107737-A1 ORGANIC LIGHT-EMITTING ELEMENT 주식회사 엘지화학 2021-06-03 WO disclosed