SCHEMBL8124172

SCHEMBL8124172

CC(C)(C)c1ccc(CCC(=O)C2CCCCCC2)cc1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 1/20 0.38
CCR5 P51681 2/20 0.38
ATM Q13315 1/20 0.37
HSD11B1 P28845 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
ALDH1A1 P00352 3/20 0.35
CYP2C19 P33261 1/20 0.35
GAA P10253 1/20 0.35
MAOB P27338 3/20 0.34
MAOA P21397 2/20 0.34
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ACHE P22303 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
SCHEMBL8119964 0.82 CCR5 (0.39) CCR5MEN1KMT2AGAARAB9A
SCHEMBL8115448 0.82 CCR5 (0.39) CCR5MEN1KMT2AGAARAB9A
SCHEMBL8838795 0.82 MEN1 (0.39) ANO1CCR5MEN1KMT2AGAA
SCHEMBL3992294 0.80 CCR5 (0.36) CCR5ATMHSD11B1MEN1KMT2A
SCHEMBL8114129 0.78 AAK1 (0.36) ANO1MEN1KMT2ACYP2C19HPGD
SCHEMBL8116754 0.77 SPHK1 (0.38) MEN1KMT2AALDH1A1GAAACHE
SCHEMBL8110363 0.77 SPHK1 (0.36) ANO1MEN1KMT2A
SCHEMBL8119961 0.77 ANO1 (0.40) ANO1MEN1KMT2AALDH1A1GAA
SCHEMBL8122289 0.75 NPC1 (0.40) ANO1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8118247 0.74 ANO1 (0.39) ANO1MEN1KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0632036-B1 Amide derivatives having anti-hypercholesteremic activity, their preparation and their therapeutic uses SANKYO CO (JP) 2000-03-01 EP disclosed
US-5614550-A ANTICHOLESTEROL AGENTS OR ARTERIOSCLEROSIS AGENTS FOR HUMANS SANKYO COMPANY, LIMITED (JP) 1997-03-25 US disclosed
US-5534529-A Substituted aromatic amides and ureas derivatives having anti-hypercholesteremic activity, their preparation and their therapeutic uses SANKYO COMPANY, LIMITED (JP) 1996-07-09 US disclosed
EP-0632036-A2 Amide and urea derivatives having anti-hypercholesteremic activity, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1995-01-04 EP disclosed