SCHEMBL31190293

SCHEMBL31190293

CCOC(=O)/C=C/C(=O)OC(C)CC

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.55
MAPT P10636 7/20 0.42
ATM Q13315 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 3/20 0.39
MDM2 Q00987 2/20 0.39
MDM4 O15151 1/20 0.39
ALDH1A1 P00352 2/20 0.38
TTR P02766 1/20 0.37
DPP4 P27487 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
HTT P42858 1/20 0.36
CYP3A4 P08684 1/20 0.35

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
SCHEMBL28757781 1.00 HCAR2 (0.55) HCAR2MAPTATMCA12CA1
SCHEMBL510759 0.89 HCAR2 (0.48) HCAR2MAPTATMCA12CA1
SCHEMBL1062134 0.89 HCAR2 (0.48) HCAR2MAPTATMCA12CA1
SCHEMBL510760 0.89 HCAR2 (0.48) HCAR2MAPTATMCA12CA1
SCHEMBL3515513 0.83 HCAR2 (0.59) HCAR2MAPTATMCA12CA1
SCHEMBL992126 0.83 HCAR2 (0.59) HCAR2MAPTATMCA12CA1
SCHEMBL3516777 0.83 HCAR2 (0.59) HCAR2MAPTATMCA12CA1
SCHEMBL992124 0.83 HCAR2 (0.59) HCAR2MAPTATMCA12CA1
Diethyl Maleate SCHEMBL15751751 0.83 HCAR2 (0.59) HCAR2MAPTATMCA12CA1
SCHEMBL7562770 0.83 HCAR2 (0.59) HCAR2MAPTATMCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024225302-A1 NOVEL FUMARIC ACID ESTER MONOMER, RESIN, AND FILM CONTAINING SAME 東ソー株式会社 2024-10-31 WO disclosed