SCHEMBL17424937

SCHEMBL17424937

CCOC(=O)C(C)(C)N(C)C(=O)c1cc(C)cc(C)c1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.43
ABCB1 P08183 4/20 0.41
CYP3A4 P08684 1/20 0.40
TPMT P51580 1/20 0.36

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
SCHEMBL668765 0.83 CNR2 (0.43) CNR2ABCB1CYP3A4
SCHEMBL9376556 0.76 CNR2 (0.39) CNR2CYP3A4
SCHEMBL27709308 0.72 CYP4F2 (0.39) CNR2CYP3A4
SCHEMBL8721674 0.71 TPMT (0.42) ABCB1CYP3A4TPMT
SCHEMBL8912352 0.69 CYP4F2 (0.42) CYP3A4
SCHEMBL16142850 0.69 ABCB1 (0.40) ABCB1CYP3A4TPMT
SCHEMBL13307504 0.69 CA12 (0.53) CYP3A4
Hydrochloric Acid SCHEMBL11688713 0.69 TPMT (0.52) ABCB1CYP3A4TPMT
SCHEMBL4859473 0.68 CA12 (0.67) CNR2CYP3A4TPMT
SCHEMBL1006734 0.67 TPMT (0.54) ABCB1TPMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2463269-B1 Bioavailable diacylhydrazine ligands for modulating the expression of exogenous genes via an ecdysone receptor complex INTREXON CORP (US) 2016-09-28 EP disclosed
EP-2460786-B1 Bioavailable diacylhydrazine ligands for modulating the expression of exogenous genes via an ecdysone receptor complex INTREXON CORP (US) 2016-01-13 EP disclosed