SCHEMBL1201231

SCHEMBL1201231

CCCOC(=O)N1CCc2c[c]ccc2C1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 3/20 0.41
WDR77 Q9BQA1 3/20 0.41
SLC6A15 Q9H2J7 1/20 0.41
ALDH1A1 P00352 1/20 0.40
TMEM97 Q5BJF2 4/20 0.39
SIGMAR1 Q99720 4/20 0.39
ESR2 Q92731 1/20 0.39
NOTUM Q6P988 2/20 0.38
MAP3K5 Q99683 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CNR2 P34972 1/20 0.38
ABHD6 Q9BV23 1/20 0.37
SMYD3 Q9H7B4 1/20 0.36
USP2 O75604 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL1202917 0.93 SMN1; SMN2 (0.46) PRMT5WDR77ALDH1A1TMEM97SIGMAR1
SCHEMBL1202085 0.91 ALDH1A1 (0.48) PRMT5WDR77ALDH1A1TMEM97SIGMAR1
SCHEMBL1201971 0.84 PRMT5 (0.48) PRMT5WDR77SLC6A15TMEM97SIGMAR1
SCHEMBL30023801 0.82 NOTUM (0.58) PRMT5WDR77ALDH1A1NOTUMMEN1
SCHEMBL1202119 0.79 ABHD6 (0.47) PRMT5WDR77SLC6A15ESR2NOTUM
SCHEMBL952312 0.79 ESR2 (0.62) PRMT5WDR77ALDH1A1ESR2ABHD6
SCHEMBL3486703 0.78 NOTUM (0.63) ALDH1A1NOTUMMEN1KMT2AHPGD
SCHEMBL23360751 0.77 NOTUM (0.43) PRMT5WDR77ALDH1A1ESR2NOTUM
SCHEMBL697852 0.76 KMT2A (0.41) ESR2NOTUMMEN1KMT2AHPGD
SCHEMBL2075762 0.76 NOTUM (0.44) ALDH1A1ESR2NOTUMMEN1KMT2A

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 2944/4885SLC6A15 4042/4885
US-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors BACE1, BACE2, APP PRMT5 2318/4885WDR77 2981/4885SLC6A15 4027/4885
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors BACE1, BACE2, APP PRMT5 2106/4885WDR77 2944/4885SLC6A15 4042/4885
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP PRMT5 2106/4885WDR77 2944/4885SLC6A15 4042/4885

“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.