SCHEMBL17416629

SCHEMBL17416629

CCc1c(OC)cccc1C(=O)N(NC(C)(C)C)C(=O)c1ccccc1OC

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.43
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
NPC1 O15118 2/20 0.41
KCNK3 O14649 2/20 0.40
KCNK9 Q9NPC2 2/20 0.40
LMNA P02545 2/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HPGD P15428 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
KDM4E B2RXH2 1/20 0.39
STAT3 P40763 1/20 0.39
PDE2A O00408 1/20 0.39
RAB9A P51151 1/20 0.38

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
SCHEMBL9102868 0.89 TSHR (0.40) NPC1LMNATP53KDM4ERAB9A
SCHEMBL18091874 0.89 MAPT (0.43) KCNK3KCNK9LMNAHSD17B10HPGD
SCHEMBL9100311 0.87 RAB9A (0.43) HDAC1HDAC6NPC1LMNARAB9A
SCHEMBL18091870 0.87 NPC1 (0.35) CTSDHDAC1HDAC6NPC1KCNK3
SCHEMBL2482845 0.86 ABCB1 (0.51) NPC1RAB9A
SCHEMBL27356523 0.86 KDM4E (0.39) NPC1LMNAHPGDKDM4ERAB9A
SCHEMBL18091865 0.85 NPC1 (0.48) NPC1LMNAHPGDKDM4ERAB9A
SCHEMBL17416645 0.84 KMT2A (0.37) LMNAHPGDRXFP1KDM4E
SCHEMBL17025773 0.83 POLB (0.43) LMNAKDM4ERAB9A
SCHEMBL18091859 0.83 CTNNB1 (0.42) NPC1HPGDTP53RAB9A

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-B1 Bioavailable diacylhydrazine ligands for modulating the expression of exogenous genes via an ecdysone receptor complex INTREXON CORP (US) 2016-01-13 EP disclosed