SCHEMBL7984485

SCHEMBL7984485

OCc1ccc2c(c1)CN(CCCc1ccccc1)C2

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.60
SIGMAR1 Q99720 8/20 0.51
GRIN2B Q13224 3/20 0.49
LTA4H P09960 1/20 0.48
HRH3 Q9Y5N1 1/20 0.46
POLB P06746 1/20 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
SCHEMBL7982882 0.85 SIGMAR1 (0.53) NAMPTSIGMAR1GRIN2BLTA4HHRH3
SCHEMBL1206388 0.81 SIGMAR1 (0.54) NAMPTSIGMAR1POLB
SCHEMBL10382817 0.81 SIGMAR1 (0.58) SIGMAR1GRIN2BLTA4HPOLB
SCHEMBL31514906 0.81 SIGMAR1 (0.54) NAMPTSIGMAR1POLB
SCHEMBL7981844 0.78 ADRA1D (0.55)
SCHEMBL7982875 0.77 SIGMAR1 (0.49) NAMPTSIGMAR1GRIN2BLTA4HHRH3
SCHEMBL14067270 0.77 NAMPT (0.44) NAMPTGRIN2B
SCHEMBL7985762 0.77 OPRM1 (0.43) NAMPTSIGMAR1LTA4HHRH3
SCHEMBL3699580 0.75 NAMPT (1.00) NAMPT
SCHEMBL10383389 0.75 SIGMAR1 (0.63) SIGMAR1

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