SCHEMBL465144

SCHEMBL465144

C=C(C(=O)OCC)C1CN1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
TSHR P16473 1/20 0.42
MAPT P10636 4/20 0.40
NPSR1 Q6W5P4 1/20 0.35
GLO1 Q04760 1/20 0.35
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 2/20 0.33
ALOX15 P16050 1/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
THRB P10828 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33

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
SCHEMBL31351975 0.80 PRCP (0.44) ALDH1A1TSHRMAPT
SCHEMBL27413912 0.79 SLC6A2 (0.41) ALDH1A1TSHRMAPT
SCHEMBL7025925 0.76
SCHEMBL5181533 0.75 ALDH1A1 (0.45) ALDH1A1TSHRMAPTNPSR1GLO1
SCHEMBL465152 0.73 ALDH1A1 (0.40) ALDH1A1TSHRMAPTNPSR1GLO1
SCHEMBL10995795 0.72 ALDH1A1 (0.42) ALDH1A1TSHRMAPTNPSR1GLO1
SCHEMBL29117857 0.72 ALDH1A1 (0.46) ALDH1A1TSHRMAPTGAATHRB
SCHEMBL5051971 0.72 ALDH1A1 (0.43) ALDH1A1TSHRMAPTNPSR1GLO1
SCHEMBL15477480 0.72 ALDH1A1 (0.36) ALDH1A1TSHRMAPTNPSR1GLO1
SCHEMBL12628504 0.72 TSHR (0.41) ALDH1A1TSHRMAPTGAA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110964400-A Aqueous wood lacquer emulsion and preparation method and application thereof 中国科学院化学研究所 2020-04-07 CN claimed
CN-110964400-A Aqueous wood lacquer emulsion and preparation method and application thereof 中国科学院化学研究所 2020-04-07 CN disclosed
WO-2012026786-A3 DISPLACEMENT DESORPTION PROCESS FOR LIGHT OLEFIN SEPARATION KOREA INSTITUTE OF ENERGY RESEARCH (KR) 2012-05-10 WO disclosed
EP-2050772-B1 CURABLE RESIN AND CURABLE COMPOSITION MITSUI CHEMICALS INC (JP) 2011-11-30 EP disclosed
US-20100036050-A1 CURABLE RESIN AND CURABLE COMPOSITION CEMEDINE CO., LTD. (JP) 2010-02-11 US disclosed
EP-2050772-A1 CURABLE RESIN AND CURABLE COMPOSITION Mitsui Chemicals Polyurethanes, Inc. (JP) 2009-04-22 EP disclosed
US-20080124552-A1 Particle With Rough Surface For Plating Or Vapor Deposition NISSHINBO INDUSTRIES, INC. (JP) 2008-05-29 US disclosed
US-20080020207-A1 Particle With Rough Surface And Process For Producing The Same NISSHINBO INDUSTRIES, INC. (JP) 2008-01-24 US disclosed