SCHEMBL9105189

SCHEMBL9105189

CCc1c(OC)cccc1C(=O)N(NC(C)(C)C)C(=O)c1cc(C)cc(C=NO)c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.43
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
GFER P55789 1/20 0.35
POLB P06746 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
PDE2A O00408 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL14688168 0.90 ABCB1 (0.43) ABCB1MAPTPOLBNPC1RAB9A
SCHEMBL2482845 0.89 ABCB1 (0.51) ABCB1NPC1RAB9A
SCHEMBL5053940 0.83 ABCB1 (0.64) ABCB1
SCHEMBL17416625 0.82 ABCB1 (0.52) ABCB1NPC1RAB9A
SCHEMBL9232983 0.81 ABCB1 (0.48) ABCB1NPC1RAB9A
SCHEMBL9101226 0.79 ABCB1 (0.47) ABCB1NPC1RAB9A
SCHEMBL17416629 0.78 CTSD (0.43) NPC1RAB9APDE2ALMNA
SCHEMBL18091865 0.78 NPC1 (0.48) ABCB1MAPTNPC1RAB9AMEN1
SCHEMBL9100311 0.78 RAB9A (0.43) ABCB1MAPTNPC1RAB9ALMNA
SCHEMBL17416624 0.77 ABCB1 (0.53) ABCB1NPC1RAB9A

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