SCHEMBL28306756

SCHEMBL28306756

O=C(O)CC(C(=O)O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.59
GAA P10253 2/20 0.59
ALDH1A1 P00352 1/20 0.59
POLB P06746 2/20 0.57
TDP1 Q9NUW8 1/20 0.57
FFAR1 O14842 3/20 0.56
PTGS2 P35354 1/20 0.53
MMP12 P39900 2/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP13 P45452 1/20 0.49
MMP14 P50281 1/20 0.49
TSHR P16473 2/20 0.47
ABCC4 O15439 1/20 0.47
LMNA P02545 1/20 0.47
PTGS1 P23219 1/20 0.47
HTT P42858 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
CTSS P25774 1/20 0.44

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
SCHEMBL27939444 0.94 L3MBTL1 (0.65) L3MBTL1GAAALDH1A1POLBTDP1
SCHEMBL29903902 0.88 L3MBTL1 (0.61) L3MBTL1GAAALDH1A1POLBTDP1
SCHEMBL377175 0.88 L3MBTL1 (0.61) L3MBTL1GAAALDH1A1POLBTDP1
SCHEMBL146867 0.88 L3MBTL1 (0.61) L3MBTL1GAAALDH1A1POLBTDP1
SCHEMBL377609 0.88 L3MBTL1 (0.61) L3MBTL1GAAALDH1A1POLBTDP1
SCHEMBL11137284 0.88 L3MBTL1 (0.71) L3MBTL1GAAALDH1A1POLBTDP1
SCHEMBL23782080 0.86 L3MBTL1 (0.59) L3MBTL1GAAALDH1A1POLBTDP1
SCHEMBL6739142 0.86 L3MBTL1 (0.59) L3MBTL1GAAALDH1A1POLBTDP1
SCHEMBL3916057 0.85 FFAR1 (0.53) L3MBTL1GAAALDH1A1POLBTDP1
SCHEMBL30372175 0.84 PTGS2 (0.57) GAAFFAR1PTGS2TSHRABCC4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117567225-A Method for preparing dicarboxylic acid compound from olefin 徐州医科大学 2024-02-20 CN disclosed
CN-110028403-B Method for synthesizing succinic acid compound 四川大学 2020-08-11 CN disclosed
CN-110028403-A A kind of method of synthesizing succinic acid class compound 四川大学 2019-07-19 CN disclosed