SCHEMBL30728533

SCHEMBL30728533

CC(=O)c1ccc(N(C)C)cc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.57
MAOA P21397 4/20 0.57
KLKB1 P03952 1/20 0.54
ALDH1A1 P00352 4/20 0.53
HPGD P15428 3/20 0.53
MAPT P10636 3/20 0.53
NPC1 O15118 2/20 0.53
MEN1 O00255 1/20 0.53
TP53 P04637 1/20 0.53
KMT2A Q03164 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MAPK1 P28482 2/20 0.52
CYP3A4 P08684 1/20 0.52
PRKDC P78527 1/20 0.42
KDM4E B2RXH2 1/20 0.42
RAB9A P51151 1/20 0.42
HSP90AA1 P07900 1/20 0.41
PDK2 Q15119 1/20 0.41
HTT P42858 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL144363 1.00 MAOB (0.57) MAOBMAOAKLKB1ALDH1A1HPGD
SCHEMBL22939649 0.86 ALDH1A1 (0.64) MAOBMAOAKLKB1ALDH1A1HPGD
SCHEMBL11108442 0.84 MAOA (0.45) MAOBMAOAKLKB1ALDH1A1HPGD
SCHEMBL729586 0.84 MAOA (0.57) MAOBMAOAKLKB1ALDH1A1HPGD
SCHEMBL12316301 0.82 MAOA (0.55) MAOBMAOAKLKB1ALDH1A1HPGD
SCHEMBL22939522 0.79 MEN1 (0.76) MAOBMAOAKLKB1ALDH1A1HPGD
SCHEMBL3165135 0.79 CA12 (0.62) MAOBMAOAKLKB1ALDH1A1HPGD
SCHEMBL8072839 0.79 MEN1 (0.61) MAOBMAOAALDH1A1HPGDMAPT
SCHEMBL12387052 0.79 CA12 (0.66) MAOBMAOAKLKB1ALDH1A1HPGD
SCHEMBL10737973 0.78 KLKB1 (0.42) MAOBMAOAKLKB1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117843507-A Chalcone photoinitiator capable of self-supplying hydrogen and application of chalcone photoinitiator in preparation of white photosensitive ink 合肥工业大学 2024-04-09 CN claimed
CN-117362268-A Lysosome targeted polar fluorescent probe and preparation method and application thereof 郑州大学 2024-01-09 CN claimed
CN-117843507-A Chalcone photoinitiator capable of self-supplying hydrogen and application of chalcone photoinitiator in preparation of white photosensitive ink 合肥工业大学 2024-04-09 CN disclosed
CN-117362268-A Lysosome targeted polar fluorescent probe and preparation method and application thereof 郑州大学 2024-01-09 CN disclosed