SCHEMBL17025834

SCHEMBL17025834

CCc1c(OC)cccc1C(=O)N(NC(=O)c1cc(C)cc(C)c1)C(C)(C=O)C=O

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 7/20 0.54
CYP3A4 P08684 1/20 0.46

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
SCHEMBL668241 0.92 ABCB1 (0.62) ABCB1CYP3A4
SCHEMBL583844 0.90 ABCB1 (0.67) ABCB1CYP3A4
SCHEMBL18091861 0.87 ABCB1 (0.55) ABCB1CYP3A4
SCHEMBL9103400 0.85 ABCB1 (0.53) ABCB1CYP3A4
SCHEMBL668094 0.84 ABCB1 (0.62) ABCB1CYP3A4
SCHEMBL9101989 0.84 ABCB1 (0.52) ABCB1CYP3A4
SCHEMBL9237580 0.82 ABCB1 (0.49) ABCB1CYP3A4
SCHEMBL29381163 0.82 ABCB1 (0.77) ABCB1CYP3A4
SCHEMBL64477 0.82 ABCB1 (0.77) ABCB1CYP3A4
SCHEMBL15465492 0.82 ABCB1 (0.49) ABCB1CYP3A4

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
US-20150240244-A1 BIOAVAILABLE DIACYLHYDRAZINE LIGANDS FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX BIOPHARMA CREDIT PLC, AS COLLATERAL AGENT (GB) 2015-08-27 US disclosed