SCHEMBL28906335

SCHEMBL28906335

O=C(O)c1ccc(C=CC(=O)c2cc(Br)ccc2O)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.72
NPSR1 Q6W5P4 3/20 0.72
L3MBTL1 Q9Y468 1/20 0.72
MAOA P21397 1/20 0.72
MAOB P27338 1/20 0.72
SMN1; SMN2 Q16637 2/20 0.61
AR P10275 2/20 0.58
CHRNA7 P36544 1/20 0.57
KDM4E B2RXH2 2/20 0.56
ALDH1A1 P00352 2/20 0.56
HSP90AA1 P07900 2/20 0.56
MEN1 O00255 1/20 0.56
LMNA P02545 1/20 0.56
POLB P06746 1/20 0.56
THRB P10828 1/20 0.56
HPGD P15428 1/20 0.56
ALOX12 P18054 1/20 0.56
APEX1 P27695 1/20 0.56
HTT P42858 1/20 0.56
RECQL P46063 1/20 0.56

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
SCHEMBL2376112 0.87 MAPT (0.74) MAPTNPSR1L3MBTL1MAOAMAOB
SCHEMBL7956659 0.87 MAPT (0.74) MAPTNPSR1L3MBTL1MAOAMAOB
SCHEMBL19603333 0.84 MAPT (1.00) MAPTNPSR1L3MBTL1MAOAMAOB
SCHEMBL5424561 0.84 MAOB (0.74) MAPTNPSR1L3MBTL1MAOAMAOB
SCHEMBL5424563 0.84 MAOB (0.74) MAPTNPSR1L3MBTL1MAOAMAOB
SCHEMBL28906329 0.83 AR (0.76) MAPTL3MBTL1MAOAMAOBAR
SCHEMBL2374997 0.81 MAPT (0.70) MAPTNPSR1L3MBTL1MAOAMAOB
SCHEMBL2374989 0.81 MAPT (0.70) MAPTNPSR1L3MBTL1MAOAMAOB
SCHEMBL4119024 0.81 GUSB (0.72) MAPTMAOAMAOBSMN1; SMN2AR
SCHEMBL4119027 0.81 GUSB (0.72) MAPTMAOAMAOBSMN1; SMN2AR

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-115304513-A Chalcone derivative with anti-inflammatory activity and synthesis method and application thereof 湖北科技学院 2022-11-08 CN disclosed