SCHEMBL5079807

SCHEMBL5079807

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

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.50
ALDH1A1 P00352 4/20 0.50
CYP3A4 P08684 2/20 0.50
HPGD P15428 1/20 0.50
TP53 P04637 3/20 0.42
HIF1A Q16665 3/20 0.42
HSD17B10 Q99714 1/20 0.42
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
SCHEMBL80818 0.94 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
Ethylene SCHEMBL28626350 0.92 TSHR (0.55) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL71730 0.92 TSHR (0.59) TSHRALDH1A1CYP3A4HPGDTP53
Methane SCHEMBL28113061 0.90 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL28323519 0.90 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
Ethylene SCHEMBL22126280 0.90 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL28208777 0.90 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL441818 0.90 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL21670464 0.89 TSHR (0.52) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL219314 0.89 TSHR (0.52) TSHRALDH1A1CYP3A4HPGDTP53

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-1273601-B1 RUBBER-MODIFIED RESIN AND THERMOPLASTIC RESIN COMPOSITION CONTAINING THE SAME KANEKA CORP (JP) 2008-02-27 EP disclosed
EP-1160290-B1 FLAME RETARDANT FOR THERMOPLASTIC RESIN AND FLAME-RETARDANT RESIN COMPOSITION KANEKA CORP (JP) 2005-05-04 EP disclosed
US-6822045-B2 MIXTURE OF ACRYLIC POLYMER AND SILICONE RUBBER KANEKA CORPORATION (JP) 2004-11-23 US disclosed
US-20030092819-A1 Rubber-modified resin and thermoplastic resin composition containing the same KANEKA CORPORATION (JP) 2003-05-15 US disclosed
EP-1273601-A1 RUBBER-MODIFIED RESIN AND THERMOPLASTIC RESIN COMPOSITION CONTAINING THE SAME KANEKA CORPORATION (JP) 2003-01-08 EP disclosed
EP-1160290-A1 FLAME RETARDANT FOR THERMOPLASTIC RESIN AND FLAME-RETARDANT RESIN COMPOSITION KANEKA CORPORATION (JP) 2001-12-05 EP disclosed