SCHEMBL8024097

SCHEMBL8024097

CC(C(=O)O)=C(O)CC(C)Cl

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GRIK1 P39086 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
SCHEMBL670992 0.80 ALDH1A1 (0.50) ALDH1A1TDP1GRIK1
SCHEMBL670991 0.80 ALDH1A1 (0.50) ALDH1A1TDP1GRIK1
SCHEMBL449035 0.78 TDP1 (0.36) ALDH1A1TDP1GRIK1
SCHEMBL8977483 0.74 ALDH1A1 (0.33) ALDH1A1TDP1
SCHEMBL8977502 0.73 ALDH1A1 (0.32) ALDH1A1TDP1
SCHEMBL158448 0.71
SCHEMBL7521295 0.71
SCHEMBL5613176 0.71
SCHEMBL6460798 0.71
SCHEMBL19210055 0.70 CPA1 (0.32) ALDH1A1TDP1

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
EP-0487305-B2 Method of purifying crude glycidyl (meth)acrylate MITSUBISHI GAS CHEMICAL CO (JP) 2000-03-29 EP claimed