SCHEMBL9101024

SCHEMBL9101024

CCc1c(OC)cccc1C(=O)N(NC(=O)c1ccccc1[N+](=O)[O-])C(C)(C)C

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.48
HTT P42858 1/20 0.46
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CTSD P07339 1/20 0.43

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
SCHEMBL5057023 0.96 ABCB1 (0.48) ABCB1HTTALDH1A1
SCHEMBL5240628 0.90 ABCB1 (0.51) ABCB1
SCHEMBL5058396 0.88 ABCB1 (0.51) ABCB1
SCHEMBL5053857 0.87 ABCB1 (0.49) ABCB1
SCHEMBL10722430 0.86 ABCB1 (0.51) ABCB1HTTALDH1A1SMN1; SMN2
SCHEMBL5062538 0.85 ABCB1 (0.55) ABCB1
SCHEMBL5064327 0.85 ABCB1 (0.47) ABCB1
SCHEMBL9102034 0.84 ABCB1 (0.54) ABCB1
SCHEMBL9714633 0.82 ALDH1A1 (0.56) ABCB1ALDH1A1CTSD
SCHEMBL9101143 0.82 ABCB1 (0.48) ABCB1

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 3 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-2463269-A1 Bioavailable diacylhydrazine ligands for modulating the expression of exogenous genes via an ecdysone receptor complex Intrexon Corporation (US) 2012-06-13 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