SCHEMBL29048969

SCHEMBL29048969

CCOC(C)(C)C(=O)OC(=O)CC

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
ALDH1A1 P00352 2/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SOAT1 P35610 1/20 0.32
CA2 P00918 1/20 0.31
NAAA Q02083 1/20 0.30
TRPA1 O75762 1/20 0.30
ABCB11 O95342 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
HTR2A P28223 1/20 0.30
PMP22 Q01453 1/20 0.30
PPARA Q07869 1/20 0.30

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
SCHEMBL29048965 0.88 CYP4F2 (0.40) CYP4F2CYP4A11ALDH1A1MGAMGAA
SCHEMBL28343617 0.80 ALOX15 (0.41) CYP4F2CYP4A11SOAT1CA2
SCHEMBL195662 0.76 CYP4F2 (0.56) CYP4F2CYP4A11ALDH1A1MGAMGAA
SCHEMBL445544 0.76 DGAT1 (0.39) CYP4F2CYP4A11ALDH1A1MGAMGAA
SCHEMBL779254 0.75 ALDH1A1 (0.38) ALDH1A1MGAMGAASIMGAM2
SCHEMBL17486950 0.74 DGAT1 (0.43) CYP4F2CYP4A11ALDH1A1CA2ABCB11
SCHEMBL3075927 0.74 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1CA2ABCB11
SCHEMBL28730460 0.74 CYP4F2 (0.42) CYP4F2CYP4A11ALDH1A1MGAMGAA
SCHEMBL14509111 0.73 SOAT1 (0.36) CYP4F2CYP4A11ALDH1A1MGAMGAA
SCHEMBL28457116 0.72 ALDH1A1 (0.36) CYP4F2CYP4A11ALDH1A1MGAMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117642410-A Ester derivatives of N4-hydroxycytidine and uses thereof 苏州春海生物医药有限公司 2024-03-01 CN disclosed
CN-116583530-A N 4 Ester derivatives of hydroxycytidine and their use 苏州春海生物医药有限公司 2023-08-11 CN disclosed