SCHEMBL1201971

SCHEMBL1201971

CC(C)COC(=O)N1CCc2c[c]ccc2C1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 12/20 0.48
WDR77 Q9BQA1 12/20 0.48
HRH1 P35367 1/20 0.42
SLC6A15 Q9H2J7 1/20 0.42
MAP3K5 Q99683 1/20 0.40
ACE P12821 1/20 0.40
KIT P10721 1/20 0.39
ABHD6 Q9BV23 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39

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
SCHEMBL1202085 0.87 ALDH1A1 (0.48) PRMT5WDR77HRH1TMEM97SIGMAR1
SCHEMBL1201231 0.84 PRMT5 (0.41) PRMT5WDR77SLC6A15MAP3K5ABHD6
SCHEMBL1202119 0.83 ABHD6 (0.47) PRMT5WDR77SLC6A15ACEABHD6
SCHEMBL15355424 0.83 PRMT5 (0.67) PRMT5WDR77ACEABHD6
SCHEMBL1202917 0.81 SMN1; SMN2 (0.46) PRMT5WDR77HRH1TMEM97SIGMAR1
SCHEMBL952312 0.78 ESR2 (0.62) PRMT5WDR77ABHD6
SCHEMBL3486703 0.77 NOTUM (0.63) ACE
SCHEMBL23360751 0.76 NOTUM (0.43) PRMT5WDR77ABHD6
SCHEMBL30404761 0.76 TMEM97 (0.47) PRMT5WDR77MAP3K5ABHD6TMEM97
SCHEMBL2075762 0.75 NOTUM (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946259-B2 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2015-02-03 US disclosed
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2014-03-06 US disclosed
US-8598353-B2 Benzazole derivatives, compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2013-12-03 US disclosed
EP-1863771-B1 BENZAZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE AS B-SECRETASE INHIBITORS HIGH POINT PHARMACEUTICALS LLC (US) 2012-11-07 EP disclosed
EP-2457901-A1 Benzazole derivatives, compositions, and methods of use as B-secretase inhibitors High Point Pharmaceuticals, LLC (US) 2012-05-30 EP disclosed
US-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2011-03-17 US disclosed
US-7893267-B2 Benzazole derivatives, compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2011-02-22 US disclosed
US-20090326006-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors VTVX HOLDINGS II LLC 2009-12-31 US disclosed
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC 2006-10-05 US 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 (4 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-20090326006-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP PRMT5 2106/4885WDR77 2944/4885HRH1 1627/4885
US-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors BACE1, BACE2, APP PRMT5 2318/4885WDR77 2981/4885HRH1 1715/4885
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors BACE1, BACE2, APP PRMT5 2106/4885WDR77 2944/4885HRH1 1627/4885
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP PRMT5 2106/4885WDR77 2944/4885HRH1 1627/4885

“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.