SCHEMBL29950859

SCHEMBL29950859

CNc1cc(O)ccc1C=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.43
TRIM24 O15164 1/20 0.43
TRIM33 Q9UPN9 1/20 0.43
PELI1 Q96FA3 2/20 0.38
ERN1 O75460 2/20 0.38
POLB P06746 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
EGFR P00533 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH5A1 P51649 1/20 0.37
ABAT P80404 1/20 0.37
APP P05067 5/20 0.37
TTR P02766 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL20865908 0.84 ALDH1A1 (0.41) TYRTRIM24TRIM33PELI1ERN1
SCHEMBL29954398 0.84 ALDH1A1 (0.41) TYRTRIM24TRIM33PELI1ERN1
SCHEMBL14428137 0.80 TYR (0.39) TYRTRIM24TRIM33PELI1ERN1
SCHEMBL7672985 0.78 EGFR (0.38) TYRTRIM24TRIM33POLBALDH1A1
SCHEMBL28299604 0.78 ALDH1A1 (0.43) ERN1KDM4EALDH1A1GAAMAPT
SCHEMBL28299606 0.76 TDP1 (0.55) ERN1POLBKDM4EALDH1A1GAA
SCHEMBL28298269 0.76 ALDH1A1 (0.42) ERN1KDM4EALDH1A1MAPTAPP
SCHEMBL26549353 0.76 APP (0.56) TYRPELI1POLBKDM4EALDH1A1
SCHEMBL29012715 0.75 ERN1 (0.37) TYRTRIM24TRIM33ERN1KDM4E
SCHEMBL29952866 0.73 TRIM24 (0.47) TYRTRIM24TRIM33ERN1POLB

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