SCHEMBL29048965

SCHEMBL29048965

CCOC(C)(C)C(=O)OC(=O)C(C)(C)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.40
CYP4A11 Q02928 2/20 0.40
SOAT1 P35610 1/20 0.36
ALDH1A1 P00352 4/20 0.33
CA2 P00918 1/20 0.33
ABCB11 O95342 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
HTR2A P28223 1/20 0.32
PMP22 Q01453 1/20 0.32
PPARA Q07869 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
FFAR3 O14843 1/20 0.32
ALOX15 P16050 1/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 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
SCHEMBL29048969 0.88 CYP4F2 (0.37) CYP4F2CYP4A11SOAT1ALDH1A1CA2
SCHEMBL28343617 0.86 ALOX15 (0.41) CYP4F2CYP4A11SOAT1CA2LMNA
SCHEMBL195662 0.82 CYP4F2 (0.56) CYP4F2CYP4A11SOAT1ALDH1A1ABCB11
SCHEMBL445544 0.82 DGAT1 (0.39) CYP4F2CYP4A11ALDH1A1CA2ABCB11
SCHEMBL3075927 0.80 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1CA2ABCB11
SCHEMBL17486950 0.80 DGAT1 (0.43) CYP4F2CYP4A11ALDH1A1CA2ABCB11
SCHEMBL14509111 0.79 SOAT1 (0.36) CYP4F2CYP4A11SOAT1ALDH1A1LMNA
SCHEMBL28457116 0.78 ALDH1A1 (0.36) CYP4F2CYP4A11SOAT1ALDH1A1ABCB11
SCHEMBL3084127 0.77 CYP4F2 (0.43) CYP4F2CYP4A11SOAT1ALDH1A1CA2
SCHEMBL3065432 0.77 CYP4F2 (0.43) CYP4F2CYP4A11SOAT1ALDH1A1CA2

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