SCHEMBL9101226

SCHEMBL9101226

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

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 5/20 0.47
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
CYP3A4 P08684 1/20 0.35

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
SCHEMBL9103547 0.92 ABCB1 (0.40) ABCB1NPC1RAB9A
SCHEMBL2482845 0.89 ABCB1 (0.51) ABCB1NPC1RAB9ACYP3A4
SCHEMBL9232983 0.85 ABCB1 (0.48) ABCB1NPC1RAB9ACYP3A4
SCHEMBL17416625 0.81 ABCB1 (0.52) ABCB1NPC1RAB9A
SCHEMBL14688168 0.81 ABCB1 (0.43) ABCB1NPC1RAB9A
SCHEMBL17025792 0.80 ABCB1 (0.47) ABCB1NPC1RAB9ACYP3A4
SCHEMBL5053899 0.80 ABCB1 (0.61) ABCB1CYP3A4
SCHEMBL29396928 0.79 ABCB1 (0.54) ABCB1NPC1RAB9ACYP3A4
SCHEMBL14801560 0.79 ABCB1 (0.46) ABCB1NPC1RAB9A
SCHEMBL22502730 0.79 ABCB1 (0.46) ABCB1NPC1RAB9ACYP3A4

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-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
EP-2460786-A1 Bioavailable diacylhydrazine ligands for modulating the expression of exogenous genes via an ecdysone receptor complex Intrexon Corporation (US) 2012-06-06 EP disclosed