SCHEMBL28426564

SCHEMBL28426564

CC(O)(C(=O)O)C(O)C(O)C(O)CO

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.43
LMNA P02545 2/20 0.41
USP2 O75604 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
KDM4E B2RXH2 2/20 0.34
TET2 Q6N021 1/20 0.32
OR51E2 Q9H255 1/20 0.31
PGD P52209 2/20 0.31
HMGCR P04035 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 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
SCHEMBL2933991 1.00 PDE4A (0.43) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Hydrochloric Acid SCHEMBL19520560 0.98 PDE4A (0.42) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL6295932 0.87 TSHR (0.38) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL9312516 0.87 TSHR (0.38) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL1829423 0.87 TSHR (0.38) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL3959086 0.83 LMNA (0.40) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL4655170 0.83 LMNA (0.40) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL27944594 0.83 LMNA (0.40) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL28603042 0.82 LMNA (0.39) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL8903598 0.82 USP2 (0.39) PDE4ALMNAUSP2SLCO1B1L3MBTL1

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-109298115-B Quantitative detection method for multiple metabolites in biological sample and metabolic chip 深圳市绘云生物科技有限公司 2020-07-28 CN claimed
CN-110092719-B Synthetic method of gulonic acid methyl ester 中国科学院大连化学物理研究所 2021-05-04 CN disclosed
CN-101167539-B Method for producing grosvenor momordca fresh fruit deodorant concentrated juice HUNAN JINNONG BIOLOG RESOURCES CO LTD 2010-10-06 CN disclosed
CN-101167539-A Method for producing grosvenor momordca fresh fruit deodorant concentrated juice HUNAN JINNONG BIOLOG RESOURCES (CN) 2008-04-30 CN disclosed