SCHEMBL28972729

SCHEMBL28972729

CCC(=O)OC1CC(=O)OC(=O)C1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 7/20 0.38
CHRM2 P08172 2/20 0.35
CHRM4 P08173 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
NAAA Q02083 2/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
BLM P54132 1/20 0.32
WRN Q14191 1/20 0.32
HIF1A Q16665 1/20 0.32
BCHE P06276 1/20 0.31

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
SCHEMBL30590682 0.81 PTPN1 (0.40) PRKCACHRM2CHRM4CHRM1CHRM3
SCHEMBL11988739 0.81 PTPN1 (0.40) PRKCACHRM2CHRM4CHRM1CHRM3
SCHEMBL28543712 0.78 PRKCA (0.39) PRKCACHRM2CHRM4CHRM1CHRM3
SCHEMBL23495094 0.72 CHRM2 (0.43) CHRM2CHRM4CHRM1CHRM3NAAA
SCHEMBL21765657 0.72 NAAA (0.48) CHRM2CHRM4CHRM1CHRM3NAAA
SCHEMBL2253713 0.72
SCHEMBL17892488 0.72 CHRM2 (0.37) PRKCACHRM2CHRM4CHRM1CHRM3
SCHEMBL13351529 0.72 MTNR1A (0.47) ALDH1A1CYP1A2CYP2C19BCHE
SCHEMBL16161014 0.71
SCHEMBL5463377 0.71 NAAA (0.41) CHRM2CHRM4CHRM1CHRM3NAAA

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
CN-115819685-B Side chain end-capped polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2025-02-11 CN claimed
CN-115819685-A Side chain end-capped polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2023-03-21 CN claimed
CN-115819685-B Side chain end-capped polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2025-02-11 CN disclosed
CN-115819685-A Side chain end-capped polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2023-03-21 CN disclosed