SCHEMBL76895

SCHEMBL76895

CC(=O)NC(C(=O)c1ccc(C)cc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.50
TP53 P04637 1/20 0.50
RAB9A P51151 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
NPSR1 Q6W5P4 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
ALDH1A1 P00352 5/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
HTT P42858 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP3A4 P08684 3/20 0.41

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
SCHEMBL76522 0.94 LMNA (0.50) LMNATP53RAB9AMEN1KMT2A
SCHEMBL77141 0.90 TDP1 (0.52) LMNAMEN1KMT2ACES2CES1
SCHEMBL6707539 0.83 ALDH1A1 (0.48) LMNATP53MEN1KMT2AL3MBTL1
SCHEMBL13052942 0.79 TDP1 (0.55) LMNARAB9ANPC1CES2CES1
SCHEMBL28457962 0.79 TDP1 (0.55) LMNARAB9ANPC1CES2CES1
SCHEMBL29291328 0.79 LMNA (0.52) LMNATP53RAB9AMEN1KMT2A
SCHEMBL28272245 0.79 ALDH1A1 (0.56) LMNATP53MEN1KMT2AL3MBTL1
SCHEMBL31258304 0.77 MAPT (0.51) LMNATP53RAB9AMEN1KMT2A
SCHEMBL4250144 0.77 SRC (0.52) LMNAKMT2AALDH1A1HPGDMAPK1
SCHEMBL627377 0.77 SRC (0.52) LMNAKMT2AALDH1A1HPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129355-B2 Nuclear receptor-based inducible gene expression system; modulating the expression of a gene in a host cell by introducing into the host cell a gene expression modulation system and activating that system using 5-ethyl-2,3-dihydro-benzo[1,4]dioxine-6-carboxylic acid (1-benzoyl-cyclopentyl)-amide INTREXON CORPORATION (US) 2012-03-06 US disclosed