SCHEMBL7971893

SCHEMBL7971893

CC(=O)N1CCCN(CCc2ccccc2)CC1.CC(C)(C)OC(N)=O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
KCNH2 Q12809 1/20 0.52
SIGMAR1 Q99720 4/20 0.50
ACHE P22303 1/20 0.50
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
SLC6A3 Q01959 1/20 0.46
CHRM3 P20309 2/20 0.45

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
SCHEMBL7983466 0.95 MEN1 (0.56) MEN1KMT2AKCNH2SIGMAR1POLB
SCHEMBL7985885 0.94 SIGMAR1 (0.59) MEN1KMT2ASIGMAR1CHRM3
SCHEMBL7986228 0.89 SIGMAR1 (0.63) MEN1KMT2ASIGMAR1
SCHEMBL7986044 0.85 SIGMAR1 (0.55) MEN1KMT2AKCNH2SIGMAR1ACHE
SCHEMBL3712707 0.80 MEN1 (0.59) MEN1KMT2AKCNH2SIGMAR1POLB
SCHEMBL7971891 0.78 SIGMAR1 (0.80) MEN1KMT2AKCNH2SIGMAR1ACHE
SCHEMBL7989733 0.78 SIGMAR1 (0.64) SIGMAR1CHRM3
SCHEMBL25238918 0.76 MEN1 (0.89) MEN1KMT2AKCNH2SIGMAR1POLB
SCHEMBL9054221 0.75 L3MBTL1 (0.64) MEN1KMT2AKCNH2SIGMAR1ACHE
SCHEMBL8527247 0.74 SIGMAR1 (0.75) MEN1KMT2AKCNH2SIGMAR1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6235731-B1 REDUCING BLOOD LIPIDS, SUGARS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-22 US disclosed
EP-0915888-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS Takeda Chemical Industries, Ltd. (JP) 1999-05-19 EP disclosed
WO-1997040051-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-30 WO disclosed