SCHEMBL28906376

SCHEMBL28906376

COc1ccc(O)c(C(=O)C=Cc2ccc(O)cc2C=O)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 6/20 0.73
MAPT P10636 4/20 0.67
MEN1 O00255 3/20 0.67
MAPK1 P28482 3/20 0.67
KMT2A Q03164 3/20 0.67
ALDH1A1 P00352 2/20 0.67
HPGD P15428 2/20 0.67
ALOX15 P16050 2/20 0.67
HSD17B10 Q99714 2/20 0.67
KDM4E B2RXH2 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
NR1H4 Q96RI1 2/20 0.60
NPC1 O15118 2/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
RAB9A P51151 1/20 0.58
TRIM24 O15164 1/20 0.55
TYR P14679 1/20 0.55
TRIM33 Q9UPN9 1/20 0.55
APP P05067 1/20 0.54

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
SCHEMBL28906370 0.83 CTSL (0.63) CHRNA7MAPTMEN1KMT2AALDH1A1
SCHEMBL634386 0.82 CHRNA7 (0.90) CHRNA7MAPTMEN1MAPK1KMT2A
SCHEMBL634385 0.82 CHRNA7 (0.90) CHRNA7MAPTMEN1MAPK1KMT2A
SCHEMBL28906359 0.81 AR (0.64) CHRNA7MAPTKMT2AALDH1A1KDM4E
SCHEMBL28906328 0.81 AR (0.63) CHRNA7MAPTMEN1KMT2AALDH1A1
SCHEMBL5082149 0.80 MAPT (1.00) CHRNA7MAPTMEN1MAPK1KMT2A
SCHEMBL5082144 0.80 MAPT (1.00) CHRNA7MAPTMEN1MAPK1KMT2A
SCHEMBL28906366 0.80 CHRNA7 (0.59) CHRNA7MAPTMEN1MAPK1KMT2A
SCHEMBL19183197 0.78 APP (0.81) CHRNA7MAPTMEN1MAPK1KMT2A
SCHEMBL19183199 0.78 APP (0.81) CHRNA7MAPTMEN1MAPK1KMT2A

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