SCHEMBL9903289

SCHEMBL9903289

CCC(NN(C(=O)c1cc(C)cc(C)c1)C(=O)c1ccc2c(c1C)OCCO2)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
HTT P42858 2/20 0.33
GAA P10253 1/20 0.33
LMNA P02545 1/20 0.33
ABCB1 P08183 1/20 0.33
TP53 P04637 1/20 0.32

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
SCHEMBL19946456 0.93 HSD17B10 (0.36) NPC1RAB9AMAPTALDH1A1NPSR1
SCHEMBL9101336 0.91 ABCB1 (0.35) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL2683389 0.86 TAS1R3 (0.37) MAPTALDH1A1HPGDABCB1
SCHEMBL19946432 0.83 ABCB1 (0.34) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL5705240 0.83 NPC1 (0.39) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL9100735 0.81 PLK1 (0.35) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL18091873 0.79 NPC1 (0.39) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL668095 0.79 ABCB1 (0.38) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL29685124 0.79 ABCB1 (0.38) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL9101450 0.75 ABCB1 (0.56) NPC1RAB9AABCB1

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-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-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