SCHEMBL7983465

SCHEMBL7983465

CC(C)(C)OC(=O)NCC(=O)N1CCN(CCc2ccccc2)CC1

nearest known ligand 0.87

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.87
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
KCNH2 Q12809 1/20 0.51
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
DRD2 P14416 3/20 0.48
TSHR P16473 1/20 0.48
NPFFR1 Q9GZQ6 1/20 0.48
NPFFR2 Q9Y5X5 1/20 0.48
P2RX7 Q99572 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
NAMPT P43490 1/20 0.47

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
SCHEMBL7971891 0.96 SIGMAR1 (0.80) SIGMAR1MEN1KMT2AKCNH2POLB
SCHEMBL7986224 0.93 SIGMAR1 (1.00) SIGMAR1DRD2
SCHEMBL7985879 0.89 SIGMAR1 (0.92) SIGMAR1DRD2
SCHEMBL1222005 0.88 SIGMAR1 (0.76) SIGMAR1MEN1KMT2ANPFFR1NPFFR2
SCHEMBL14691386 0.81 SIGMAR1 (0.66) SIGMAR1MEN1KMT2ATSHRNPFFR1
SCHEMBL3712707 0.81 MEN1 (0.59) SIGMAR1MEN1KMT2AKCNH2POLB
SCHEMBL24833934 0.79 SIGMAR1 (0.57) SIGMAR1DRD2
SCHEMBL14892399 0.78 SIGMAR1 (0.62) SIGMAR1MEN1KMT2ATSHRNPFFR1
SCHEMBL14902467 0.78 SIGMAR1 (0.62) SIGMAR1MEN1KMT2AKCNH2TSHR
SCHEMBL1306785 0.78 SIGMAR1 (0.61) SIGMAR1NPFFR1NPFFR2P2RX7

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