SCHEMBL5570780

SCHEMBL5570780

COCCOC(=O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
SLC13A5 Q86YT5 11/20 0.38
KDM4E B2RXH2 6/20 0.36
LMNA P02545 5/20 0.36
CYP2D6 P10635 4/20 0.36
CYP1A2 P05177 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SLC13A2 Q13183 1/20 0.36
SLC13A3 Q8WWT9 1/20 0.36
TSHR P16473 4/20 0.35
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.35
HMGCR P04035 1/20 0.34
CHRM1 P11229 1/20 0.34
TBXA2R P21731 1/20 0.34
ADRA1A P35348 1/20 0.34
HIF1A Q16665 3/20 0.34
CYP3A4 P08684 2/20 0.34
NFKB1 P19838 2/20 0.34

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
Ammonia Solution, Strong SCHEMBL28774936 0.98 ALDH1A1 (0.52) ALDH1A1SLC13A5KDM4ELMNACYP2D6
SCHEMBL28510642 0.95 ALDH1A1 (0.48) ALDH1A1SLC13A5KDM4ELMNACYP2D6
SCHEMBL426934 0.91 ALDH1A1 (0.65) ALDH1A1SLC13A5KDM4ELMNACYP2D6
Ethylene SCHEMBL10931218 0.87 ALDH1A1 (0.60) ALDH1A1SLC13A5KDM4ELMNACYP2D6
SCHEMBL11302169 0.85 ALDH1A1 (0.58) ALDH1A1SLC13A5KDM4ELMNACYP2D6
SCHEMBL10931226 0.85 ALDH1A1 (0.58) ALDH1A1SLC13A5KDM4ELMNACYP2D6
Propene SCHEMBL424592 0.84 ALDH1A1 (0.52) ALDH1A1SLC13A5KDM4ELMNACYP2D6
SCHEMBL2861746 0.84 ALDH1A1 (0.56) ALDH1A1SLC13A5KDM4ELMNACYP2D6
SCHEMBL426260 0.83 ALDH1A1 (0.60) ALDH1A1SLC13A5KDM4ELMNACYP2D6
SCHEMBL426065 0.83 ALDH1A1 (0.60) ALDH1A1SLC13A5KDM4ELMNACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103663558-A Plumbum zinc niobium titanate (PZNT) chemical solution and ferroelectric film preparation method UNIV SHANGHAI 2014-03-26 CN claimed
CN-103663558-A Plumbum zinc niobium titanate (PZNT) chemical solution and ferroelectric film preparation method UNIV SHANGHAI 2014-03-26 CN disclosed
EP-1740679-A2 LUBRICANT AND FUEL COMPOSITIONS CONTAINING HYDROXY POLYCARBOXYLIC ACID ESTERS CHEMTURA CORPORATION (US) 2007-01-10 EP disclosed
WO-2005087904-A2 LUBRICANT AND FUEL COMPOSITIONS CONTAINING HYDROXY POLYCARBOXYLIC ACID ESTERS CHEMTURA CORPORATION (US) 2005-09-22 WO disclosed
EP-0596941-A1 ACID-SUBSTITUTED TERNARY ACETAL POLYMERS AND USE THEREOF IN PHOTOSENSITIVE COMPOSITIONS AND LITHOGRAPHIC PRINTING PLATES. EASTMAN KODAK CO (US) 1994-05-18 EP disclosed