SCHEMBL9903268

SCHEMBL9903268

CCCC(N(NC(=O)c1cc(C)cc(C)c1)C(=O)c1ccc2c(c1C)OCCO2)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 2/20 0.38
MAPT P10636 2/20 0.38
RAB9A P51151 2/20 0.38
ABCB1 P08183 2/20 0.36
HSD17B10 Q99714 1/20 0.35
CYP3A4 P08684 1/20 0.35
TAS1R3 Q7RTX0 2/20 0.34
TAS1R1 Q7RTX1 2/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.33
HTT P42858 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
SCHEMBL18091873 0.94 NPC1 (0.39) ALDH1A1NPC1MAPTRAB9AABCB1
SCHEMBL2683648 0.93 ABCB1 (0.36) ALDH1A1NPC1MAPTRAB9AABCB1
SCHEMBL29684859 0.93 ABCB1 (0.36) ALDH1A1NPC1MAPTRAB9AABCB1
SCHEMBL668634 0.93 ABCB1 (0.36) ALDH1A1NPC1MAPTRAB9AABCB1
SCHEMBL17416637 0.90 PLK1 (0.39) ALDH1A1NPC1MAPTRAB9AHSD17B10
SCHEMBL29685124 0.86 ABCB1 (0.38) ALDH1A1NPC1MAPTRAB9AABCB1
SCHEMBL668095 0.86 ABCB1 (0.38) ALDH1A1NPC1MAPTRAB9AABCB1
SCHEMBL2684734 0.86 ABCB1 (0.38) ALDH1A1NPC1MAPTRAB9AABCB1
SCHEMBL668085 0.86 ABCB1 (0.38) ALDH1A1NPC1MAPTRAB9AABCB1
SCHEMBL29786240 0.86 ABCB1 (0.38) ALDH1A1NPC1MAPTRAB9AABCB1

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-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