SCHEMBL75658

SCHEMBL75658

COC(=O)C(NC(=O)Nc1ccccc1C(F)(F)F)C(C)C

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.60
MAPK1 P28482 1/20 0.60
ALDH1A1 P00352 6/20 0.55
HPGD P15428 1/20 0.55
NPSR1 Q6W5P4 1/20 0.52
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
LMNA P02545 1/20 0.51
THRB P10828 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
EPHX2 P34913 1/20 0.49
KDM4E B2RXH2 1/20 0.49
TSHR P16473 1/20 0.48
GAA P10253 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
SCHEMBL75068 0.81 POLB (0.60) POLBMAPK1ALDH1A1HPGDEPHX2
SCHEMBL75067 0.81 POLB (0.60) POLBMAPK1ALDH1A1HPGDEPHX2
SCHEMBL8360431 0.76 CASP3 (0.50) POLBALDH1A1HPGDNPSR1MEN1
SCHEMBL2300809 0.76 CSGALNACT1 (0.84)
SCHEMBL11620551 0.75 ALDH1A1 (0.73) POLBMAPK1ALDH1A1HPGDMEN1
SCHEMBL514342 0.74 POLB (0.60) POLBMAPK1ALDH1A1HPGDMEN1
SCHEMBL22103682 0.74 ALDH1A1 (0.66) POLBMAPK1ALDH1A1MEN1KMT2A
SCHEMBL10947190 0.73 ALDH1A1 (0.61) POLBMAPK1ALDH1A1HPGDMEN1
SCHEMBL16127720 0.72 GAA (0.62) POLBMAPK1ALDH1A1HPGDMEN1
SCHEMBL11613058 0.72 MAPK1 (0.57) POLBMAPK1ALDH1A1HPGDMEN1

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 POLB 3813/4885MAPK1 250/4885ALDH1A1 97/4885

“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.