SCHEMBL28245573

SCHEMBL28245573

CC(=O)N(Br)c1cccc2c1oc1ccccc12

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.46
▸ GAA P10253 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ MAOA P21397 3/20 0.40
▸ CA12 O43570 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.37
▸ AHR P35869 1/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ TTR P02766 1/20 0.36
▸ KDM5A P29375 1/20 0.36

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
SCHEMBL20886912 0.83 ALOX5 (0.47) ALOX5GAAMEN1CYP2C19KMT2A
SCHEMBL14295747 0.78 ALOX5 (0.43) ALOX5GAAMEN1CYP2C19KMT2A
SCHEMBL23046767 0.76 ALOX5 (0.44) ALOX5GAAMEN1CYP2C19KMT2A
SCHEMBL14295748 0.75 ALOX5 (0.40) ALOX5GAAMEN1CYP2C19KMT2A
SCHEMBL19929766 0.75 ALOX5 (0.43) ALOX5GAAMEN1CYP2C19KMT2A
SCHEMBL23310406 0.75 ALOX5 (0.50) ALOX5MEN1CYP2C19KMT2AMAOA
SCHEMBL6372657 0.75 ALOX5 (0.45) ALOX5MEN1CYP2C19KMT2AMAOA
SCHEMBL20887131 0.74 ALOX5 (0.43) ALOX5GAAMEN1CYP2C19KMT2A
SCHEMBL1939814 0.74 GAA (0.46) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL28317409 0.74 SIGMAR1 (0.50) GAACA12CA9KDM4ENPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110526887-A Compound and its organic electronic device SHANGHAI RONGCAI PHOTOELECTRIC MAT CO LTD 2019-12-03 — — CN disclosed
CN-108623546-A Compound and organic electronic device thereof 彩丰精技股份有限公司 2018-10-09 — — CN disclosed
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