SCHEMBL20033110

SCHEMBL20033110

Brc1cccc2oc3c(-c4cccc5ccccc45)cccc3c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 3/20 0.42
▸ MAOB P27338 3/20 0.42
▸ ALOX5 P09917 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ PIK3CD O00329 2/20 0.39
▸ PIK3CB P42338 2/20 0.39
▸ PRKDC P78527 2/20 0.39
▸ CDC14B O60729 1/20 0.36
▸ CDC14A Q9UNH5 1/20 0.36
▸ KMT2A Q03164 2/20 0.35
▸ ESR1 P03372 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL25853300 0.84 CDC14B (0.43) MAOAMAOBALOX5ALDH1A1MAPT
SCHEMBL31588936 0.83 L3MBTL1 (0.44) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL19784562 0.83 L3MBTL1 (0.44) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL30747823 0.83 ALOX5 (0.50) MAOAMAOBALOX5ALDH1A1MAPT
SCHEMBL19651721 0.83 ALOX5 (0.50) MAOAMAOBALOX5ALDH1A1MAPT
SCHEMBL28285207 0.82 ALDH1A1 (0.47) MAOAMAOBALOX5ALDH1A1MAPT
SCHEMBL19651715 0.81 ALOX5 (0.58) MAOAMAOBALOX5ALDH1A1MAPT
SCHEMBL22707606 0.81 ALOX5 (0.41) MAOAMAOBALOX5ALDH1A1MAPT
SCHEMBL18820559 0.81 ALOX5 (0.44) MAOAMAOBALOX5ALDH1A1MAPT
SCHEMBL18820563 0.81 ALOX5 (0.44) MAOAMAOBALOX5ALDH1A1MAPT

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
US-9938287-B1 Blue fluorescence dopant compound and organic electroluminescent device using the same NANJING TOPTO MATERIALS CO.,LTD. (CN) 2018-04-10 — — US disclosed
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