SCHEMBL968489

SCHEMBL968489

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

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 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
SCHEMBL969825 0.88 HPGD (0.31) HPGDTSHR
SCHEMBL4904711 0.77 THRB (0.40) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL29644640 0.73 TSHR (0.44) HPGDTSHR
SCHEMBL8731568 0.72 THRB (0.40) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL270021 0.70 TSHR (0.53) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL27835337 0.70 TSHR (0.41) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL28034536 0.70 HPGD (0.34) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL8731570 0.70 ALDH1A1 (0.52) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL10697742 0.69 TSHR (0.43) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL5271167 0.69 TSHR (0.45) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2

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
US-8530539-B2 Curable resin composition for nanoimprint DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2013-09-10 US disclosed
US-20120141738-A1 CURABLE RESIN COMPOSITION FOR NANOIMPRINT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2012-06-07 US disclosed
US-20110008577-A1 PROCESS FOR PRODUCTION OF FINE STRUCTURE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2011-01-13 US disclosed
EP-2261007-A1 PROCESS FOR PRODUCTION OF NANOSTRUCTURES Daicel Chemical Industries, Ltd. (JP) 2010-12-15 EP disclosed
EP-2246371-A1 CURABLE RESIN COMPOSITION FOR NANOIMPRINT Daicel Chemical Industries, Ltd. (JP) 2010-11-03 EP disclosed
US-20090252976-A1 COVER MEMBER FOR PUSH BUTTON SWITCH AND PROCESS FOR PRODUCING THE SAME SHIN-ETSU POLYMER CO., LTD. (JP) 2009-10-08 US disclosed