SCHEMBL1204544

SCHEMBL1204544

C/C=C\C(CC(=O)O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
SLC22A6 Q4U2R8 1/20 0.36
GRIK1 P39086 2/20 0.34
GRIK2 Q13002 2/20 0.34
FOLH1 Q04609 2/20 0.33
MAPT P10636 1/20 0.32
HDAC2 Q92769 1/20 0.31
GABRR1 P24046 2/20 0.31
LMNA P02545 1/20 0.31
MME P08473 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
SCHEMBL1204546 1.00 TDP1 (0.40) TDP1SMN1; SMN2SLC22A6GRIK1GRIK2
Hydrochloric Acid SCHEMBL531802 0.98 TDP1 (0.39) TDP1SMN1; SMN2SLC22A6GRIK1GRIK2
SCHEMBL28904430 0.98 TDP1 (0.39) TDP1SMN1; SMN2SLC22A6GRIK1GRIK2
SCHEMBL27637478 0.84 SLC22A6 (0.35) TDP1SMN1; SMN2SLC22A6MAPTHDAC2
Hydrochloric Acid SCHEMBL4148164 0.79 GABRR1 (0.34) GRIK1GRIK2GABRR1LMNA
SCHEMBL5076843 0.78
SCHEMBL10928741 0.78
SCHEMBL5076842 0.78
SCHEMBL15447441 0.78
SCHEMBL40726 0.77 TDP1 (0.37) TDP1SMN1; SMN2SLC22A6GRIK1GRIK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0391653-A2 Lubricant compositions ETHYL PETROLEUM ADDITIVES LIMITED (GB) 1990-10-10 EP claimed
EP-0285711-A1 Thermally stable sulfonate compositions KING INDUSTRIES, INC. (US) 1988-10-12 EP claimed
US-8536103-B2 Liquid extreme pressure additive THE LUBRIZOL CORPORATION 2013-09-17 US disclosed
US-20110028363-A1 Liquid Extreme Pressure Additive THE LUBRIZOL CORPORATION 2011-02-03 US disclosed
EP-2250242-A2 LIQUID EXTREME PRESSURE ADDITIVE The Lubrizol Corporation (US) 2010-11-17 EP disclosed
WO-2009111235-A2 LIQUID EXTREME PRESSURE ADDITIVE THE LUBRIZOL CORPORATION (US) 2009-09-11 WO disclosed