SCHEMBL8679379

SCHEMBL8679379

C=C(C)C(=O)OC.CCC(CO)(CO)CO

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.60
TSHR P16473 3/20 0.39
THRB P10828 1/20 0.37
TET2 Q6N021 1/20 0.32
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
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

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
Methacrylic Acid SCHEMBL8447841 0.94 ALDH1A1 (0.54) ALDH1A1TSHRTHRB
Methacrylic Acid SCHEMBL6271117 0.94 ALDH1A1 (0.54) ALDH1A1TSHRTHRB
Methacrylic Acid SCHEMBL7628795 0.94 ALDH1A1 (0.54) ALDH1A1TSHRTHRB
Methacrylic Acid SCHEMBL29256031 0.94 ALDH1A1 (0.54) ALDH1A1TSHRTHRB
SCHEMBL5697061 0.86 ALDH1A1 (0.39) ALDH1A1TSHRTHRBTP53CYP3A4
Alcohol SCHEMBL9723847 0.83 ALDH1A1 (0.79) ALDH1A1TSHRTHRBTET2
SCHEMBL15667705 0.82 THRB (0.44) ALDH1A1TSHRTHRBKDM4EPKM
Methacrylic Acid SCHEMBL25365789 0.82 ALDH1A1 (0.34) ALDH1A1THRBTP53CYP3A4MAPK1
Methacrylic Acid SCHEMBL28296610 0.82 ALDH1A1 (0.34) ALDH1A1THRBTP53CYP3A4MAPK1
SCHEMBL27543559 0.81 ALDH1A1 (0.68) ALDH1A1TSHRTHRBTET2MAPK1

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
CN-118064080-A Acrylate epoxy resin hybridization adhesive 东风汽车集团有限公司 2024-05-24 CN disclosed
EP-3898854-B1 LOW SPECULAR REFLECTANCE SURFACE AND COATING COMPOSITION EASTMAN KODAK CO (US) 2024-04-10 EP disclosed
CN-102336860-A Preparation method of phthalophos molecular imprinting polymer UNIV TIANJIN SCIENCE & TECH 2012-02-01 CN disclosed
CN-100487820-C Low-smoke halogen-free combustion-preventing cable insulation and jacket material for nuclear power plant YOUYOU JIN (CN) 2009-05-13 CN disclosed
CN-1996502-A Low-smoke halogen-free combustion-preventing cable insulation and jacket material for nuclear power plant JIN YOUYOU (CN) 2007-07-11 CN disclosed
EP-0820478-A1 WATERBORNE POLYMERS HAVING PENDANT ALLYL GROUPS EASTMAN CHEMICAL COMPANY (US) 1998-01-28 EP disclosed