SCHEMBL75902

SCHEMBL75902

COC(=O)C12CC3CC(C1)C(N1CC(C)(c4cccc(Cl)c4)NC1=O)C(C3)C2

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 11/20 0.39
HSD11B2 P80365 2/20 0.39
NR1H4 Q96RI1 1/20 0.37
SCN9A Q15858 2/20 0.37
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
P2RX7 Q99572 1/20 0.34

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
SCHEMBL75513 0.90 HSD11B1 (0.44) HSD11B1HSD11B2NR1H4
SCHEMBL75464 0.89 HSD11B1 (0.43) HSD11B1HSD11B2NR1H4
SCHEMBL75749 0.89 HSD11B1 (0.43) HSD11B1HSD11B2NR1H4
SCHEMBL76478 0.89 HSD11B1 (0.43) HSD11B1HSD11B2NR1H4
SCHEMBL4079039 0.87 SCN9A (0.43) HSD11B1HSD11B2SCN9AMAPK1NPSR1
SCHEMBL4084557 0.86 SCN9A (0.39) HSD11B1HSD11B2SCN9A
SCHEMBL4081955 0.85 DGAT1 (0.37) HSD11B1HSD11B2SCN9A
SCHEMBL75289 0.84 HSD11B1 (0.50) HSD11B1
SCHEMBL4079305 0.84 TOP2A (0.39) HSD11B1HSD11B2SCN9AP2RX7
SCHEMBL4083851 0.83 SCN9A (0.39) HSD11B1HSD11B2SCN9AP2RX7

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129423-B2 1-Adamantan-2-yl-3-benzyl-1,3-dihydro-imidazol-2-one; 11beta-hydroxysteroid dehydrogenases (11beta-HSD) inhibitor; antidiabetic, hypotensive, hypoglycemic agent; resist hyperglycemia provoked by obesity or stress; HOFFMAN-LA ROCHE INC. (US) 2012-03-06 US disclosed
EP-2308851-A1 Imidazolone and imidazolidinone derivatives as 11B-HSD1 inhibitors for the treatment of diabetes F. Hoffmann-La Roche AG (CH) 2011-04-13 EP disclosed
EP-2104665-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. Hoffmann-Roche AG (CH) 2009-09-30 EP disclosed
US-20080103183-A1 NEW IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS HOFFMANN-LA ROCHE INC. 2008-05-01 US disclosed
WO-2008046758-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-24 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 (1 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-20080103183-A1 NEW IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS HSD11B1, HSD17B1, HSD17B11 HSD11B1 1/4885HSD11B2 6/4885NR1H4 204/4885

“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.