SCHEMBL4076534

SCHEMBL4076534

C=CC(=O)OCC(O)C[Si](OCC)(OCC)OCC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.50
HPGD P15428 2/20 0.41
ALDH1A1 P00352 5/20 0.37
TP53 P04637 3/20 0.37
HIF1A Q16665 3/20 0.37
CYP3A4 P08684 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.36
THRB P10828 1/20 0.35
USP2 O75604 1/20 0.31
MAPT P10636 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
SCHEMBL4249654 0.83 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL30376807 0.80 TSHR (0.50) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL27821520 0.78 TSHR (0.61) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL34872 0.78 TSHR (0.61) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28785943 0.78 TSHR (0.61) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL27779858 0.78 TSHR (0.38) TSHRHPGDALDH1A1
SCHEMBL241400 0.78 TSHR (0.39) TSHRHPGDALDH1A1CYP3A4
SCHEMBL95157 0.78 TSHR (0.64) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL12570110 0.77 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL109189 0.77 TSHR (0.47) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8664350-B2 Polymeric coupling agents LUBRIZOL LIMITED (GB) 2014-03-04 US disclosed
EP-2084219-B1 POLYMERIC COUPLING AGENTS LUBRIZOL LTD (GB) 2012-09-05 EP disclosed
US-20090306252-A1 Polymeric Coupling Agents LUBRIZOL LIMITED (GB) 2009-12-10 US disclosed
EP-2084219-A1 POLYMERIC COUPLING AGENTS Lubrizol Limited (GB) 2009-08-05 EP disclosed
WO-2008049840-A1 POLYMERIC COUPLING AGENTS LUBRIZOL LIMITED (GB) 2008-05-02 WO disclosed