SCHEMBL1024880

SCHEMBL1024880

C=CC(=O)OCCC[Si](C)(OC)OC.C=CC(=O)OCCC[Si](OCC)(OCC)OCC

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.49
HPGD P15428 1/20 0.49
ALDH1A1 P00352 4/20 0.45
CYP3A4 P08684 2/20 0.45
TP53 P04637 3/20 0.38
HIF1A Q16665 3/20 0.38
HSD17B10 Q99714 1/20 0.38
THRB P10828 2/20 0.36
ATM Q13315 1/20 0.33
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HCAR2 Q8TDS4 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
SCHEMBL996122 0.93 TSHR (0.42) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL219155 0.90 TSHR (0.50) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL4585244 0.90 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28009250 0.90 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL93561 0.90 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL221477 0.89 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL109047 0.88 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL107213 0.88 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL5079807 0.88 TSHR (0.50) TSHRHPGDALDH1A1CYP3A4TP53
Hydrogen Peroxide SCHEMBL28128571 0.88 TSHR (0.58) TSHRHPGDALDH1A1CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0857771-A2 Aqueous adhesive composition, and bonding process and bonded article making use of the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-08-12 EP claimed
EP-2275841-B1 Manufacturing method of hard coat liquid and plastic lens manufacturing method thereof. HOYA CORP (JP) 2014-12-10 EP disclosed
EP-2275841-A2 Manufacturing method of hard coat liquid and plastic lens manufacturing method thereof HOYA CORPORATION (JP) 2011-01-19 EP disclosed