SCHEMBL3760073

SCHEMBL3760073

C=CC(=O)OC(CC)[N+](C)(C)CC

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.37
HPGD P15428 1/20 0.36
ALDH1A1 P00352 4/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.31
THRB P10828 2/20 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
Sulfuric Acid SCHEMBL28088492 0.93 TSHR (0.33) TSHRHPGD
SCHEMBL3764767 0.85 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL129465 0.83 ALOX15 (0.39) TSHRHPGDALDH1A1TP53HIF1A
Iodide SCHEMBL1301568 0.83 TSHR (0.38) TSHRHPGDALDH1A1TP53HIF1A
Bromide SCHEMBL1301958 0.83 TSHR (0.38) TSHRHPGDALDH1A1TP53HIF1A
Fluoride Ion SCHEMBL1302572 0.83 TSHR (0.38) TSHRHPGDALDH1A1TP53HIF1A
Bromide SCHEMBL130776 0.81 TSHR (0.37) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL3764876 0.79 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL27775176 0.79 TSHR (0.40) TSHRHPGDTP53HIF1ACYP3A4
Bromide SCHEMBL28987034 0.79 TSHR (0.40) TSHRHPGDALDH1A1TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111971116-B Dispersant composition, coloring composition and color filter 大塚化学株式会社 2022-06-28 CN disclosed
EP-1980544-B1 Process for producing powder KAO CORP (JP) 2016-11-16 EP disclosed
EP-1693352-B1 SURFACTANT COMPOSITION KAO CORP (JP) 2016-03-23 EP disclosed
US-7846876-B2 Surfactant composition KAO CORPORATION (JP) 2010-12-07 US disclosed
US-20080262129-A1 mixing an anionic aromatic compound (sodium p-toluenesulfonate), a cationic surfactant polydiallyldimethylammonium chloride and water to obtain a viscous material and feeding the viscous material heated at the specific temperature to the drying step; less caking; modifying the rheology KAO CORPORATION (JP) 2008-10-23 US disclosed
EP-1980544-A2 Process for producing powder Kao Corporation (JP) 2008-10-15 EP disclosed
US-20080058227-A1 Surfactant Composition KAO CORPORATION (JP) 2008-03-06 US disclosed
EP-1693352-A1 SURFACTANT COMPOSITION Kao Corporation (JP) 2006-08-23 EP disclosed