SCHEMBL1168360

SCHEMBL1168360

O=C(c1cccc(OCC2CCOCC2)c1)N1C2CCC1CC(O)C2

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 3/20 0.45
ALDH1A1 P00352 1/20 0.43
SLC2A1 P11166 1/20 0.42
CYP2D6 P10635 2/20 0.41
ATXN2 Q99700 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
VNN1 O95497 1/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
MGLL Q99685 1/20 0.39
FABP1 P07148 1/20 0.38
DGAT1 O75907 1/20 0.38
CYP3A4 P08684 1/20 0.38
SOAT1 P35610 1/20 0.38
NAAA Q02083 1/20 0.38
OPRK1 P41145 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL1169210 0.90 NR1H4 (0.50) NR1H4VNN1RAB9ANPC1MGLL
SCHEMBL1168210 0.89 ALDH1A1 (0.42) ALDH1A1L3MBTL1VNN1RAB9ANPC1
SCHEMBL1168497 0.79 NR1H4 (0.64) NR1H4ALDH1A1SLC2A1FABP1DGAT1
SCHEMBL13806579 0.76 NR1H4 (0.48) NR1H4ALDH1A1SLC2A1CYP2D6ATXN2
SCHEMBL16031001 0.76 SLC2A1 (0.52) NR1H4ALDH1A1SLC2A1CYP2D6RAB9A
SCHEMBL14135552 0.74 ALDH1A1 (0.42) NR1H4ALDH1A1SLC2A1CYP2D6ATXN2
SCHEMBL16032613 0.74 XDH (0.47) NR1H4ALDH1A1SLC2A1CYP2D6ATXN2
SCHEMBL19381184 0.72 NR1H4 (0.43) NR1H4ALDH1A1MGLLFABP1DGAT1
SCHEMBL28323610 0.72 NR1H4 (0.58) NR1H4RAB9ANPC1FABP1DGAT1
SCHEMBL3098610 0.70 CHRNB4 (0.57) ALDH1A1SLC2A1CYP2D6CYP3A4

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110039853-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC 2011-02-17 US claimed
EP-2150526-A2 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE High Point Pharmaceuticals, LLC (US) 2010-02-10 EP claimed
WO-2008101914-A2 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC (GB) 2008-08-28 WO claimed
EP-2150526-B1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE VTV THERAPEUTICS LLC (US) 2017-09-20 EP disclosed
EP-2150526-B1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE VTV THERAPEUTICS LLC (US) 2017-09-20 EP disclosed
US-8907096-B2 N-adamantyl benzamides as inhibitors of 11-β-hydroxysteroid dehydrogenase HIGH POINT PHARMACEUTICALS, LLC (US) 2014-12-09 US disclosed
US-8907096-B2 N-adamantyl benzamides as inhibitors of 11-β-hydroxysteroid dehydrogenase HIGH POINT PHARMACEUTICALS, LLC (US) 2014-12-09 US disclosed
US-8907096-B2 N-adamantyl benzamides as inhibitors of 11-β-hydroxysteroid dehydrogenase HIGH POINT PHARMACEUTICALS, LLC (US) 2014-12-09 US disclosed
US-20140315905-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE VTV THERAPEUTICS LLC 2014-10-23 US disclosed
US-20140315905-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE VTV THERAPEUTICS LLC 2014-10-23 US disclosed
US-20140315905-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE VTV THERAPEUTICS LLC 2014-10-23 US disclosed
US-20130231341-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC (US) 2013-09-05 US disclosed
US-20130231341-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC (US) 2013-09-05 US disclosed
US-8383820-B2 N-adamantyl benzamides as inhibitors of 11-β-hydroxysteroid dehydrogenase HIGH POINT PHARMACEUTICALS, LLC (US) 2013-02-26 US disclosed
US-8383820-B2 N-adamantyl benzamides as inhibitors of 11-β-hydroxysteroid dehydrogenase HIGH POINT PHARMACEUTICALS, LLC (US) 2013-02-26 US disclosed
US-8383820-B2 N-adamantyl benzamides as inhibitors of 11-β-hydroxysteroid dehydrogenase HIGH POINT PHARMACEUTICALS, LLC (US) 2013-02-26 US disclosed
US-20110039853-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC 2011-02-17 US disclosed
US-20110039853-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC 2011-02-17 US disclosed
EP-2150526-A2 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE High Point Pharmaceuticals, LLC (US) 2010-02-10 EP disclosed
WO-2008101914-A2 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC (GB) 2008-08-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110039853-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HSD11B1, HSD3B1, HSD17B1 NR1H4 223/4885ALDH1A1 116/4885SLC2A1 2393/4885
US-20130231341-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HSD11B1, HSD3B1, HSD17B1 NR1H4 223/4885ALDH1A1 116/4885SLC2A1 2393/4885
US-20140315905-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HSD11B1, HSD3B1, HSD17B1 NR1H4 223/4885ALDH1A1 116/4885SLC2A1 2393/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.