SCHEMBL351605

SCHEMBL351605

C=CCOCC(=C)C(=O)OCCOCCOC1CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.32
ALDH1A1 P00352 3/20 0.32
GAA P10253 1/20 0.32
TP53 P04637 2/20 0.32
TSHR P16473 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL19837897 0.99 ALDH1A1 (0.33) NAAAALDH1A1GAATP53TSHR
SCHEMBL352685 0.97 ALDH1A1 (0.33) NAAAALDH1A1GAA
SCHEMBL19837887 0.96 NAAA (0.32) NAAAALDH1A1GAA
SCHEMBL25803015 0.83 ALDH1A1 (0.44) ALDH1A1TP53TSHRHIF1AHSD17B10
SCHEMBL25803009 0.83 ALDH1A1 (0.44) ALDH1A1TP53TSHRHIF1AHSD17B10
SCHEMBL25803012 0.83 ALDH1A1 (0.44) ALDH1A1TP53TSHRHIF1AHSD17B10
SCHEMBL25432267 0.83 THRB (0.36) NAAA
SCHEMBL351604 0.82 ALDH1A1 (0.33) ALDH1A1GAA
SCHEMBL351882 0.81 ALDH1A1 (0.32) ALDH1A1GAA
SCHEMBL351554 0.79 EPHX1 (0.36) NAAAALDH1A1GAA

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
WO-2020162475-A1 CURABLE RESIN COMPOSITION キヤノン株式会社 2020-08-13 WO disclosed
US-20180037758-A1 Ink Composition For Three-Dimensional Modeling, Ink Set, And Method For Producing Three-Dimensional Model Konica Minolta, Inc. (JP) 2018-02-08 US disclosed
EP-2415751-B1 ALPHA-(UNSATURATED ALKOXYALKYL) ACRYLATE COMPOSITION AND PROCESS FOR PRODUCTION THEREOF NIPPON CATALYTIC CHEM IND (JP) 2014-11-26 EP disclosed
US-8796492-B2 α-(unsaturated alkoxyalkyl) acrylate composition and process for production thereof NIPPON SHOKUBAI CO., LTD. (JP) 2014-08-05 US disclosed
EP-2415751-A1 ALPHA-(UNSATURATED ALKOXYALKYL) ACRYLATE COMPOSITION AND PROCESS FOR PRODUCTION THEREOF Nippon Shokubai Co., Ltd. (JP) 2012-02-08 EP disclosed
US-20120016095-A1 a-(UNSATURATED ALKOXYALKYL) ACRYLATE COMPOSITION AND PROCESS FOR PRODUCTION THEREOF NIPPON SHOKUBAI CO., LTD. (JP) 2012-01-19 US disclosed