SCHEMBL7270699

SCHEMBL7270699

C=CC(=O)OCCC[Si](CCCOC(=O)C=C)(O[Si](C)(C)C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C

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
SCHEMBL3419804 0.86 TSHR (0.56) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL1705924 0.83 ATM (0.40) TSHRALDH1A1CYP3A4HPGDATM
SCHEMBL3664640 0.81 TSHR (0.50) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL712918 0.80 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL374776 0.80 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL331043 0.80 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL344379 0.80 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL8655278 0.80 TSHR (0.46) TSHRALDH1A1THRB
SCHEMBL395328 0.79 TSHR (0.55) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL8963456 0.79 TSHR (0.55) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003086959-A2 TRANSFER METHOD FOR THE PRODUCTION OF MICROSTRUCTURED SUBSTRATES Institut für Neue Materialien Gemeinnützige GmbH (DE) 2003-10-23 WO disclosed
EP-1248685-A2 METHOD FOR PRODUCING A MICROSTRUCTURED SURFACE RELIEF BY EMBOSSING THIXOTROPIC LAYERS INSTITUT FÜR NEUE MATERIALIEN GEM. GMBH (DE) 2002-10-16 EP disclosed
WO-2001051220-A2 METHOD FOR PRODUCING A MICROSTRUCTURED SURFACE RELIEF BY EMBOSSING THIXOTROPIC LAYERS INSTITUT FÜR NEUE MATERIALIEN GEM. GMBH (DE) 2001-07-19 WO disclosed