SCHEMBL11041374

SCHEMBL11041374

CCCC=C(C)C(=O)OC(=O)C(Cl)(Cl)Cl

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 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
SCHEMBL21714633 0.77 GRIK1 (0.34) CYP2D6CYP2C19
SCHEMBL3896936 0.77 CYP2D6 (0.33) CYP2D6CYP2C19
SCHEMBL8026442 0.77 CYP2D6 (0.35) CYP2D6CYP2C19
SCHEMBL28423343 0.76 CYP2D6 (0.31) CYP2D6CYP2C19
SCHEMBL3173863 0.76 BACE1 (0.34) CYP2D6CYP2C19
SCHEMBL27885956 0.74 EP300 (0.34) CYP2D6CYP2C19
SCHEMBL27621557 0.73 CYP2D6 (0.40) CYP2D6CYP2C19
SCHEMBL15191938 0.73 MGAM (0.40) CYP2D6CYP2C19
SCHEMBL7863676 0.73 CYP2D6 (0.37) CYP2D6CYP2C19
SCHEMBL22023124 0.73 GRIK1 (0.32) CYP2D6CYP2C19

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-0128701-A1 Acrylate and methacrylate monomers and polymers and process for thermoformed articles MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-12-19 EP disclosed