SCHEMBL8930066

SCHEMBL8930066

CC(COOCC(C)C(=O)O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.46
CYP1A2 P05177 1/20 0.46
NAALAD2 Q9Y3Q0 3/20 0.44
FOLH1 Q04609 2/20 0.44
TP53 P04637 1/20 0.40
ENPEP Q07075 2/20 0.39
BLM P54132 1/20 0.39
ACE2 Q9BYF1 1/20 0.37
LTA4H P09960 1/20 0.35
RNPEP Q9H4A4 1/20 0.35

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
SCHEMBL11043718 0.82 ACE2 (0.44) GABRR1CYP1A2ACE2
SCHEMBL15910175 0.82 GABRR1 (0.46) GABRR1CYP1A2NAALAD2FOLH1TP53
SCHEMBL11529145 0.81 GABRR1 (0.37) GABRR1CYP1A2NAALAD2FOLH1TP53
SCHEMBL758635 0.81 MEN1 (0.35) GABRR1CYP1A2NAALAD2FOLH1
SCHEMBL11933048 0.80
SCHEMBL1708891 0.80
SCHEMBL143520 0.80
SCHEMBL10371577 0.78
SCHEMBL3422576 0.78 GABRR1 (0.42) GABRR1CYP1A2NAALAD2FOLH1TP53
SCHEMBL10590102 0.78 GABRR1 (0.42) GABRR1CYP1A2NAALAD2FOLH1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0233299-B1 OPTICAL RESIN AND PROCESS FOR PREPARING THE SAME NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1991-03-13 EP claimed
CN-117143521-A Steel protective coating composition and preparation method and application thereof 雷神定制钢涂料有限责任公司 2023-12-01 CN disclosed
EP-2774968-B1 OPTICALLY ISOTROPIC LIQUID CRYSTAL MEDIUM AND OPTICAL DEVICE JNC CORP (JP) 2019-11-20 EP disclosed
EP-0790289-A1 Polymeric material for liquid crystal/polymer composite film, liquid crystal/polymer composite film, record display medium, and use thereof DAI NIPPON PRINTING CO., LTD. (JP) 1997-08-20 EP disclosed