SCHEMBL7986228

SCHEMBL7986228

CC(=O)N1CCN(CCCc2ccccc2)CC1.CC(C)(C)OC(N)=O

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 14/20 0.63
FAAH O00519 1/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ADORA3 P0DMS8 1/20 0.48
HTR2A P28223 1/20 0.48
HTR7 P34969 1/20 0.48
OPRM1 P35372 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
SCHEMBL7985885 0.96 SIGMAR1 (0.59) SIGMAR1FAAHMEN1KMT2A
SCHEMBL7983466 0.93 MEN1 (0.56) SIGMAR1MEN1KMT2AHTR2A
SCHEMBL7971893 0.89 MEN1 (0.52) SIGMAR1MEN1KMT2A
SCHEMBL7971782 0.84 SIGMAR1 (0.69) SIGMAR1FAAHADORA3HTR2AHTR7
SCHEMBL30671736 0.81 SIGMAR1 (0.70) SIGMAR1FAAHHTR7
SCHEMBL7989733 0.80 SIGMAR1 (0.64) SIGMAR1FAAHADORA3HTR2AHTR7
SCHEMBL7986224 0.77 SIGMAR1 (1.00) SIGMAR1FAAH
SCHEMBL3712707 0.76 MEN1 (0.59) SIGMAR1MEN1KMT2A
SCHEMBL8526553 0.76 SIGMAR1 (0.59) SIGMAR1KMT2AADORA3HTR2AHTR7
SCHEMBL27497536 0.76 HTR2A (0.72) HTR2AHTR7

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