SCHEMBL30385181

SCHEMBL30385181

CCOC(=O)OCOP(=O)(O)O

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
SOAT1 P35610 1/20 0.46
LPAR3 Q9UBY5 5/20 0.38
LPAR1 Q92633 3/20 0.38
LPAR2 Q9HBW0 3/20 0.38
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALOX15 P16050 1/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
TPI1 P60174 1/20 0.34
PPARD Q03181 1/20 0.34
LPAR6 P43657 1/20 0.33
LPAR4 Q99677 1/20 0.33
LPAR5 Q9H1C0 1/20 0.33
ENPP2 Q13822 1/20 0.33
TRPA1 O75762 1/20 0.33

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
SCHEMBL1068126 0.89 TPI1 (0.41) ALDH1A1LPAR3LPAR1LPAR2TPI1
SCHEMBL16368268 0.87 ALDH1A1 (0.56) ALDH1A1SOAT1LMNAHSD17B10ALOX15
SCHEMBL16647537 0.83 ALDH1A1 (0.52) ALDH1A1SOAT1LMNAHSD17B10ALOX15
SCHEMBL14283709 0.83 ALDH1A1 (0.56) ALDH1A1SOAT1LMNAHSD17B10ALOX15
SCHEMBL38660105 0.81 ALDH1A1 (0.54) ALDH1A1SOAT1LPAR3LPAR1LPAR2
SCHEMBL17753927 0.80 TPI1 (0.40) LPAR3LPAR1LPAR2TPI1ENPP2
SCHEMBL30384633 0.79 TSHR (0.36) ALDH1A1LPAR3LPAR1LPAR2TPI1
SCHEMBL16333381 0.79 ALDH1A1 (0.46) ALDH1A1SOAT1LMNAHSD17B10ALOX15
Phosphoric Acid SCHEMBL28164744 0.79 ALDH1A1 (0.72) ALDH1A1SOAT1LMNAHSD17B10ALOX15
SCHEMBL3750750 0.78 ALDH1A1 (0.44) ALDH1A1SOAT1LMNAHSD17B10ALOX15

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
CN-110022881-B Inhibitors of CD 73-mediated immunosuppression 艾库斯生物科学有限公司 2023-05-02 CN disclosed