SCHEMBL8115448

SCHEMBL8115448

CC(C)(C)c1ccc(CCC(=O)CCC2CCCCCC2)cc1N

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ACHE P22303 8/20 0.37
HTR4 Q13639 8/20 0.37
NPC1 O15118 2/20 0.36
GAA P10253 1/20 0.36
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL8119964 1.00 CCR5 (0.39) CCR5MEN1KMT2AACHEHTR4
SCHEMBL8116754 0.92 SPHK1 (0.38) MEN1KMT2AACHEHTR4NPC1
SCHEMBL8838795 0.90 MEN1 (0.39) CCR5MEN1KMT2ANPC1GAA
SCHEMBL8119961 0.90 ANO1 (0.40) MEN1KMT2AACHEHTR4NPC1
SCHEMBL8114129 0.83 AAK1 (0.36) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL8122289 0.83 NPC1 (0.40) MEN1KMT2AACHEHTR4NPC1
SCHEMBL8124172 0.82 ANO1 (0.38) CCR5MEN1KMT2AACHEGAA
SCHEMBL8110363 0.82 SPHK1 (0.36) MEN1KMT2A
SCHEMBL8118247 0.82 ANO1 (0.39) MEN1KMT2ANPC1RAB9A
SCHEMBL8115980 0.81 MAPT (0.38) CCR5MEN1KMT2AGAASMN1; SMN2

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