SCHEMBL970917

SCHEMBL970917

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

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
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

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
SCHEMBL968774 0.86 TSHR (0.36) TSHRHPGD
SCHEMBL109906 0.85 TSHR (0.36) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL28465284 0.84 TSHR (0.37) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL10889317 0.84 TSHR (0.34) TSHRHPGD
SCHEMBL7866745 0.80 TSHR (0.36) TSHRHPGD
SCHEMBL20603539 0.80 TSHR (0.33) TSHRHPGD
SCHEMBL10888478 0.78 TSHR (0.34) TSHRHPGD
SCHEMBL2476564 0.77 TSHR (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL4603163 0.77 THRB (0.32) TSHR
SCHEMBL1680181 0.76 TSHR (0.37) TSHRALDH1A1TP53CYP3A4MAPK1

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