SCHEMBL14764985

SCHEMBL14764985

CCCC(NNC(=O)c1cccc(OC)c1CC)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47
LMNA P02545 1/20 0.40
STAT3 P40763 2/20 0.39
RAB9A P51151 6/20 0.39
NPC1 O15118 5/20 0.39
CTSD P07339 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.38
TSHR P16473 2/20 0.37
GAA P10253 1/20 0.36
PRSS1 P07477 1/20 0.36
CTSG P08311 1/20 0.36
CTRB1 P17538 1/20 0.36
CMA1 P23946 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL22069493 1.00 TAS1R3 (0.47) TAS1R3TAS1R1LMNASTAT3RAB9A
SCHEMBL19946462 1.00 TAS1R3 (0.47) TAS1R3TAS1R1LMNASTAT3RAB9A
SCHEMBL2682576 0.87 TAS1R3 (0.48) TAS1R3TAS1R1LMNARAB9ANPC1
SCHEMBL19946452 0.87 TAS1R3 (0.48) TAS1R3TAS1R1LMNARAB9ANPC1
SCHEMBL22380835 0.81 TAS1R3 (0.44) TAS1R3TAS1R1LMNARAB9ATSHR
SCHEMBL668773 0.81 TAS1R3 (0.44) TAS1R3TAS1R1LMNARAB9ATSHR
SCHEMBL668914 0.79 LMNA (0.46) TAS1R3TAS1R1LMNASTAT3RAB9A
SCHEMBL3774894 0.79 TAS1R3 (0.42) TAS1R3TAS1R1TSHRPRSS1CTSG
SCHEMBL3766136 0.78 STAT3 (0.52) LMNASTAT3RAB9ANPC1CTSD
SCHEMBL669098 0.77 ABCB1 (0.46) TAS1R3TAS1R1LMNASTAT3RAB9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167458-B1 CHIRAL DIACYLHYDRAZINE LIGANDS FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX INTREXON CORP (US) 2018-03-14 EP claimed
CN-110139933-A Frataxin expression construct 英特瑞克斯顿股份有限公司 2019-08-16 CN disclosed
EP-2751072-A1 CRYSTALLINE DIACYLHYDRAZINE AND THE USE THEREOF Intrexon Corporation (US) 2014-07-09 EP disclosed
WO-2013036758-A8 CRYSTALLINE DIACYLHYDRAZINE AND THE USE THEREOF INTREXON CORPORATION (US) 2013-10-03 WO disclosed
WO-2013036758-A1 CRYSTALLINE DIACYLHYDRAZINE AND THE USE THEREOF INTREXON CORPORATION (US) 2013-03-14 WO disclosed