SCHEMBL352515

SCHEMBL352515

C=CCOCC(=C)C(=O)OCC1CO1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
MGLL Q99685 3/20 0.32
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
Ethane SCHEMBL22325466 0.97 ALDH1A1 (0.54) ALDH1A1TP53CYP3A4MGLLTSHR
SCHEMBL352474 0.88 ALDH1A1 (0.40) ALDH1A1TP53CYP3A4MGLL
SCHEMBL350047 0.85 LMNA (0.47) ALDH1A1MGLL
SCHEMBL9066252 0.83 ALDH1A1 (0.57) ALDH1A1TP53CYP3A4MGLLTSHR
SCHEMBL23474852 0.83 ALDH1A1 (0.36) ALDH1A1
SCHEMBL22325468 0.82 ALDH1A1 (0.51) ALDH1A1TP53CYP3A4MGLLTSHR
SCHEMBL878365 0.81 ALDH1A1 (0.59) ALDH1A1TP53CYP3A4MGLL
SCHEMBL11496080 0.81 ALDH1A1 (0.73) ALDH1A1TP53CYP3A4TSHR
SCHEMBL18317966 0.80 ALDH1A1 (0.58) ALDH1A1TP53CYP3A4MGLL
SCHEMBL352594 0.80 ALDH1A1 (0.57) ALDH1A1TP53CYP3A4MGLL

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