SCHEMBL29953761

SCHEMBL29953761

CNc1ccc(C=O)c(O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.52
TRIM24 O15164 2/20 0.52
TRIM33 Q9UPN9 2/20 0.52
EGFR P00533 2/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
PRKDC P78527 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
THRB P10828 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
CASP1 P29466 1/20 0.39
RECQL P46063 1/20 0.39
HIF1A Q16665 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ERN1 O75460 7/20 0.39

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
SCHEMBL23048251 1.00 TYR (0.52) TYRTRIM24TRIM33EGFRPIK3CD
SCHEMBL22820565 0.84 ERN1 (0.52) TRIM24TRIM33ERN1
Bromide SCHEMBL7633785 0.82 ERN1 (0.50) TRIM24TRIM33ERN1
SCHEMBL20593802 0.80 ERN1 (0.41) TYRTRIM24TRIM33EGFRALDH1A1
SCHEMBL11333958 0.79 TYR (0.47) TYRTRIM24TRIM33EGFRPIK3CD
SCHEMBL1527112 0.79 PKM (0.56) TYRTRIM24TRIM33ALDH1A1CYP3A4
SCHEMBL11658744 0.78 TYR (0.46) TYRTRIM24TRIM33ALDH1A1HPGD
SCHEMBL7672985 0.78 EGFR (0.38) TYRTRIM24TRIM33EGFRALDH1A1
SCHEMBL2766868 0.78 ALDH1A1 (0.45) TYREGFRALDH1A1CYP3A4ERN1
SCHEMBL25234610 0.77 MAPT (0.38) EGFRALDH1A1TP53CYP3A4THRB

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed