SCHEMBL24780286

SCHEMBL24780286

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

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.35
ALDH1A1 P00352 3/20 0.32
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 2/20 0.30
FFAR3 O14843 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
SCHEMBL28972737 0.85 SOAT1 (0.54) SOAT1ALDH1A1CYP4F2CYP4A11LMNA
SCHEMBL27793139 0.83 CYP4F2 (0.42) SOAT1ALDH1A1CYP4F2CYP4A11LMNA
SCHEMBL13776376 0.83 DGAT1 (0.33) ALDH1A1CYP4F2CYP4A11
SCHEMBL29048958 0.77 TDP1 (0.33) SOAT1ALDH1A1TDP1FFAR3
SCHEMBL3258251 0.77 SOAT1 (0.36) SOAT1ALDH1A1LMNAHSD17B10FFAR3
SCHEMBL28324952 0.75 SOAT1 (0.35) SOAT1ALDH1A1LMNAHSD17B10FFAR3
SCHEMBL28056608 0.75 ALDH1A1 (0.32) ALDH1A1LMNAHSD17B10
SCHEMBL5874374 0.73 ALDH1A1 (0.31) ALDH1A1
SCHEMBL29048965 0.72 CYP4F2 (0.40) SOAT1ALDH1A1CYP4F2CYP4A11LMNA
SCHEMBL5851722 0.70 GAA (0.41) SOAT1ALDH1A1CYP4F2CYP4A11LMNA

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
WO-2022262845-A1 ESTER DERIVATIVES OF N4-HYDROXYCYTIDINE AND USE THEREOF SUZHOU SPRING-SEA BIO-PHARMACEUTICALS CO., LTD. (CN) 2022-12-22 WO disclosed