SCHEMBL4239238

SCHEMBL4239238

CS(=O)(=O)c1ccc(CNC(=O)c2cc(-c3ccccc3)cc3nc(N)[nH]c23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 1/20 0.49
POLB P06746 1/20 0.49
GALR3 O60755 1/20 0.48
NR2F2 P24468 1/20 0.48
MAPK8 P45983 11/20 0.48
MAPK9 P45984 11/20 0.48
MAPK10 P53779 9/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CYP2C9 P11712 1/20 0.45
NAMPT P43490 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
TACR3 P29371 1/20 0.44
GSK3B P49841 1/20 0.42
PRKD3 O94806 1/20 0.42

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
SCHEMBL4239231 0.89 KDM4E (0.50) MEN1KMT2AKDM4EPOLBGALR3
SCHEMBL4242380 0.83 MAPK8 (0.49) MAPK8MAPK9MAPK10CYP2C9NAMPT
SCHEMBL4234886 0.83 ELANE (0.48) MAPK8MAPK9MAPK10CYP2C9NAMPT
SCHEMBL1201849 0.80 HDAC3 (0.42) MEN1KMT2AKDM4EPOLBGALR3
SCHEMBL4239390 0.76 NAMPT (0.53) MAPK8MAPK9MAPK10CYP2C9NAMPT
SCHEMBL4239965 0.76 SMN1; SMN2 (0.55) KMT2AGALR3NR2F2MAPK10GAA
SCHEMBL4241186 0.74 KMT2A (0.55) MEN1KMT2AKDM4EPOLBTDP1
SCHEMBL4239542 0.74 CYP2C9 (0.49) KDM4EMAPK8MAPK9MAPK10ALDH1A1
SCHEMBL4241746 0.73 PDE4B (0.47) MEN1KMT2AMAPK8MAPK9MAPK10
SCHEMBL4235903 0.73 MAPK8 (0.45) MAPK8MAPK9MAPK10ALDH1A1CYP2C9

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 6 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
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 MEN1 2918/4885KMT2A 4094/4885KDM4E 3510/4885
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors BACE1, BACE2, APP MEN1 2918/4885KMT2A 4094/4885KDM4E 3510/4885
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP MEN1 2918/4885KMT2A 4094/4885KDM4E 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.