SCHEMBL7985885

SCHEMBL7985885

CC(=O)N1CCCN(CCCc2ccccc2)CC1.CC(C)(C)OC(N)=O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 11/20 0.59
CHRM3 P20309 3/20 0.52
FAAH O00519 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL7986228 0.96 SIGMAR1 (0.63) SIGMAR1FAAHMEN1KMT2A
SCHEMBL7971893 0.94 MEN1 (0.52) SIGMAR1CHRM3MEN1KMT2A
SCHEMBL7983466 0.89 MEN1 (0.56) SIGMAR1MEN1KMT2A
SCHEMBL7989733 0.85 SIGMAR1 (0.64) SIGMAR1CHRM3FAAH
SCHEMBL7971782 0.81 SIGMAR1 (0.69) SIGMAR1FAAH
SCHEMBL8526553 0.80 SIGMAR1 (0.59) SIGMAR1CHRM3KMT2A
SCHEMBL7985879 0.79 SIGMAR1 (0.92) SIGMAR1CHRM3FAAH
SCHEMBL7986044 0.78 SIGMAR1 (0.55) SIGMAR1CHRM3MEN1KMT2A
SCHEMBL30671736 0.78 SIGMAR1 (0.70) SIGMAR1FAAH
SCHEMBL8525748 0.76 SIGMAR1 (0.90) SIGMAR1CHRM3FAAH

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