SCHEMBL4239339

SCHEMBL4239339

Cc1ccc(CNC(=O)c2cccc3nc(C(N)=O)[nH]c23)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.52
ALDH1A1 P00352 4/20 0.52
KDM4E B2RXH2 3/20 0.52
HSD17B10 Q99714 1/20 0.47
MAPT P10636 5/20 0.46
ESR1 P03372 1/20 0.46
MAPK10 P53779 1/20 0.46
KMT2A Q03164 1/20 0.46
ASAH1 Q13510 1/20 0.45
LMNA P02545 3/20 0.43
TP53 P04637 3/20 0.43
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43

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
SCHEMBL4239959 0.90 SMN1; SMN2 (0.53) HPGDMAPTESR1MAPK10KMT2A
SCHEMBL4241582 0.89 POLA1 (0.46) HPGDALDH1A1KDM4EKMT2ALMNA
SCHEMBL4246314 0.89 SMN1; SMN2 (0.50) ALDH1A1KDM4EMAPTKMT2ALMNA
SCHEMBL4239186 0.88 HPGD (0.50) HPGDALDH1A1MAPTKMT2ALMNA
SCHEMBL4241181 0.87 KMT2A (0.54) ALDH1A1KDM4EHSD17B10KMT2A
SCHEMBL4239341 0.86 HPGD (0.57) HPGDALDH1A1KDM4EHSD17B10MAPT
SCHEMBL4246334 0.86 KLKB1 (0.43) MAPTESR1MAPK10KMT2A
SCHEMBL4242333 0.83 AURKA (0.44) MAPTESR1MAPK10KMT2A
SCHEMBL4241525 0.83 PARP1 (0.41) HPGDMAPTESR1MAPK10KMT2A
SCHEMBL4244271 0.83 HTR2C (0.49)

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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 HPGD 1702/4885ALDH1A1 1717/4885KDM4E 3510/4885
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP HPGD 1702/4885ALDH1A1 1717/4885KDM4E 3510/4885

“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.