SCHEMBL28075996

SCHEMBL28075996

CCCCC=C(C)C(=O)ONC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.33
GRIK1 P39086 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
CCR2 P41597 1/20 0.30
ACHE P22303 1/20 0.30
EPHX1 P07099 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
SCHEMBL27993770 0.90 CYP2D6 (0.31)
SCHEMBL1680054 0.82 PKM (0.32)
SCHEMBL915649 0.82 PKM (0.32)
SCHEMBL28113218 0.81 EP300 (0.36) EP300GRIK1CNR2CCR2EPHX1
SCHEMBL689957 0.78 EP300 (0.39) EP300GRIK1CCR2EPHX1
SCHEMBL2771421 0.78 EP300 (0.39) EP300GRIK1CCR2EPHX1
SCHEMBL9799762 0.77 EP300 (0.36) EP300GRIK1
SCHEMBL9799758 0.77 EP300 (0.36) EP300GRIK1
SCHEMBL7754867 0.76 EP300 (0.41) EP300GRIK1
SCHEMBL27885956 0.75 EP300 (0.34) EP300GRIK1

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
CN-103792603-B Retroreflecting material and goods 3M创新有限公司 2016-07-06 CN disclosed