SCHEMBL4244535

SCHEMBL4244535

NC(=O)C(C(=O)Nc1nc2ccccc2s1)c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 4/20 0.73
ACP1 P24666 3/20 0.65
PTPN7 P35236 1/20 0.65
PTPN12 Q05209 1/20 0.65
PTPN13 Q12923 1/20 0.65
SSU72 Q9NP77 1/20 0.65
NCS1 P62166 1/20 0.62
SCD O00767 3/20 0.60
MEN1 O00255 3/20 0.58
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
KMT2A Q03164 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
GAA P10253 2/20 0.57
MAPT P10636 2/20 0.57
ALDH1A1 P00352 2/20 0.57
ADORA1 P30542 1/20 0.57
DYRK1A Q13627 1/20 0.57
NFKB1 P19838 2/20 0.57
NFKB2 Q00653 2/20 0.57

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
SCHEMBL13949524 0.85 CSNK1D (1.00) CSNK1DACP1PTPN7PTPN12PTPN13
SCHEMBL17287819 0.82 CSNK1D (0.67) CSNK1DACP1PTPN7PTPN12PTPN13
SCHEMBL5184333 0.82 CSNK1D (0.67) CSNK1DACP1PTPN7PTPN12PTPN13
SCHEMBL17287822 0.80 CSNK1D (0.75) CSNK1DACP1PTPN7PTPN12PTPN13
SCHEMBL230181 0.79 GAA (0.71) CSNK1DACP1SCDMEN1NPC1
SCHEMBL31078931 0.79 GAA (0.71) CSNK1DACP1SCDMEN1NPC1
SCHEMBL18289707 0.79 ACP1 (1.00) CSNK1DACP1PTPN7PTPN12PTPN13
SCHEMBL9036463 0.79 NPC1 (0.74) CSNK1DACP1PTPN7PTPN12PTPN13
SCHEMBL30553310 0.79 NPC1 (0.74) CSNK1DACP1PTPN7PTPN12PTPN13
Hydrochloric Acid SCHEMBL1841407 0.78 GAA (0.69) CSNK1DACP1SCDMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC 2006-10-05 US claimed
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-2457901-A1 Benzazole derivatives, compositions, and methods of use as B-secretase inhibitors High Point Pharmaceuticals, LLC (US) 2012-05-30 EP 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 (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-20090326006-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP CSNK1D 682/4885ACP1 2887/4885PTPN7 4767/4885
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors BACE1, BACE2, APP CSNK1D 682/4885ACP1 2887/4885PTPN7 4767/4885
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP CSNK1D 682/4885ACP1 2887/4885PTPN7 4767/4885

“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.