SCHEMBL7757770

SCHEMBL7757770

C=CC(=O)NC(C)OC(=O)C=C

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.58
ACACB O00763 2/20 0.38
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 6/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HPGD P15428 1/20 0.32
TGM2 P21980 2/20 0.32
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31
GAA P10253 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30

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
Dimethylamine SCHEMBL28373336 0.96 TSHR (0.54) TSHRACACBCYP2C19ALDH1A1MAPK1
SCHEMBL15455540 0.87 TSHR (0.42) TSHRALDH1A1HPGDTP53HIF1A
SCHEMBL8982426 0.85 TSHR (0.41) TSHRALDH1A1HPGDTP53HIF1A
SCHEMBL9618695 0.85 TSHR (0.41) TSHRALDH1A1HPGDTP53HIF1A
SCHEMBL28145669 0.83 TSHR (0.39) TSHRHPGD
SCHEMBL701216 0.83 TSHR (0.39) TSHRALDH1A1HPGD
SCHEMBL28681811 0.81 TSHR (0.56) TSHRACACBCYP2C19ALDH1A1MAPK1
SCHEMBL9292139 0.80 TSHR (0.37) TSHR
SCHEMBL28500937 0.80 TSHR (0.41) TSHRACACBALDH1A1MAPK1HPGD
SCHEMBL202494 0.80

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
JP-63240999-A None JP disclosed
CN-119686157-A Composition and method for increasing wet and dry paper strength 索理思科技开曼公司 2025-03-25 CN disclosed
CN-113785029-B Composition and method for increasing wet and dry paper strength 索理思科技开曼公司 2025-01-07 CN disclosed
WO-2020040045-A1 COMPOSITION, PRODUCTION METHOD FOR COMPOSITION, AND PRODUCTION METHOD FOR UNSATURATED COMPOUND 昭和電工株式会社 2020-02-27 WO disclosed
JP-2001270920-A ACTIVE RAY-CURABLE COMPOSITION DAINIPPON INK & CHEM INC 2001-10-02 JP disclosed
JP-S63240999-A DEHYDRATION OF ORGANIC SLUDGE EBARA INFILCO CO LTD 1988-10-06 JP disclosed