SCHEMBL5605402

SCHEMBL5605402

COc1cc(C=O)cc(Sc2ccccc2)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.48
ALDH1A1 P00352 5/20 0.46
TRIM24 O15164 1/20 0.46
HPGD P15428 1/20 0.46
ALDH5A1 P51649 1/20 0.46
ABAT P80404 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TRIM33 Q9UPN9 1/20 0.46
ERN1 O75460 5/20 0.44
AOX1 Q06278 1/20 0.43
TSHR P16473 1/20 0.42
EGFR P00533 4/20 0.42
ERBB2 P04626 3/20 0.42
PKM P14618 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
SIRT1 Q96EB6 1/20 0.40
ALOX5 P09917 1/20 0.40
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL5113878 0.81 TTR (0.55) TTRALDH1A1TRIM24HPGDALDH5A1
SCHEMBL10486972 0.81 TTR (0.55) TTRALDH1A1TRIM24HPGDALDH5A1
Syringaldehyde SCHEMBL28592447 0.79 ALDH1A1 (0.54) TTRALDH1A1TRIM24HPGDALDH5A1
Syringaldehyde SCHEMBL2110596 0.76 ALDH1A1 (0.62) ALDH1A1TRIM24HPGDALDH5A1ABAT
Syringaldehyde SCHEMBL30119623 0.76 ALDH1A1 (0.62) ALDH1A1TRIM24HPGDALDH5A1ABAT
Syringaldehyde SCHEMBL150376 0.76 ALDH1A1 (0.62) ALDH1A1TRIM24HPGDALDH5A1ABAT
Syringaldehyde SCHEMBL9328650 0.75 PKM (0.59) ALDH1A1TRIM24HPGDALDH5A1ABAT
SCHEMBL2649406 0.75 ERN1 (0.51) TTRALDH1A1TRIM24HPGDALDH5A1
Syringaldehyde SCHEMBL31412823 0.74 PKM (0.62) ALDH1A1TRIM24HPGDALDH5A1ABAT
SCHEMBL9761379 0.74 TTR (0.51) TTRALDH1A1TRIM24HPGDALDH5A1

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
WO-2007051314-A1 CURCUMINOID COMPOUNDS FOR INHIBITING PLASMINOGEN ACTIVATOR INHIBITOR-1 AMERICAN DIAGNOSTICA INC. (US) 2007-05-10 WO disclosed