SCHEMBL3274728

SCHEMBL3274728

O=C(O)CC(C(=O)O)c1ccccc1.OCc1ccc(CO)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
GAA P10253 1/20 0.51
POLB P06746 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
CYP2C19 P33261 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TSHR P16473 2/20 0.45
CPA1 P15085 2/20 0.44
GABBR2 O75899 1/20 0.44
GABBR1 Q9UBS5 1/20 0.44
CPB1 P15086 1/20 0.44
CPA3 P15088 1/20 0.44
CPB2 Q96IY4 1/20 0.44
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
CYP1A2 P05177 1/20 0.44
EPHX1 P07099 1/20 0.43

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
SCHEMBL28219425 0.93 L3MBTL1 (0.59) ALDH1A1L3MBTL1GAAPOLBTDP1
SCHEMBL29903902 0.89 L3MBTL1 (0.61) ALDH1A1L3MBTL1GAAPOLBTDP1
SCHEMBL146867 0.89 L3MBTL1 (0.61) ALDH1A1L3MBTL1GAAPOLBTDP1
SCHEMBL377609 0.89 L3MBTL1 (0.61) ALDH1A1L3MBTL1GAAPOLBTDP1
SCHEMBL377175 0.89 L3MBTL1 (0.61) ALDH1A1L3MBTL1GAAPOLBTDP1
SCHEMBL23782080 0.87 L3MBTL1 (0.59) ALDH1A1L3MBTL1GAAPOLBTDP1
SCHEMBL6739142 0.87 L3MBTL1 (0.59) ALDH1A1L3MBTL1GAAPOLBTDP1
SCHEMBL3274730 0.82 CASP1 (0.41) ALDH1A1L3MBTL1TDP1SMN1; SMN2KMT2A
SCHEMBL11137284 0.80 L3MBTL1 (0.71) ALDH1A1L3MBTL1GAAPOLBTDP1
SCHEMBL6510253 0.79 ESR1 (0.50) ALDH1A1L3MBTL1GAAPOLBTDP1

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-7691556-B2 Antireflective compositions for photoresists AZ ELECTRONIC MATERIALS USA CORP. (US) 2010-04-06 US claimed