SCHEMBL970918

SCHEMBL970918

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

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.45
HPGD P15428 1/20 0.45
ALDH1A1 P00352 4/20 0.44
TP53 P04637 3/20 0.44
HIF1A Q16665 3/20 0.44
HSD17B10 Q99714 1/20 0.44
THRB P10828 2/20 0.42
CYP3A4 P08684 2/20 0.41
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL968775 0.86 TSHR (0.46) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL10889323 0.85 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28465283 0.83 TSHR (0.46) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL7866747 0.80 TSHR (0.46) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL109906 0.79 TSHR (0.36) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL10890684 0.79 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL10888481 0.79 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL10659550 0.78 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28019893 0.76 TSHR (0.49) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL10883864 0.75 TSHR (0.41) 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 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