SCHEMBL4165231

SCHEMBL4165231

CN(C(=O)O)c1ccc(B2OCC(C)(C)CO2)cn1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.32
USP30 Q70CQ3 1/20 0.31
DGAT1 O75907 1/20 0.31
HCAR3 P49019 1/20 0.30

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
SCHEMBL1180748 0.83 TTK (0.37) SNCAUSP30DGAT1
SCHEMBL29855985 0.82 DGAT1 (0.45) USP30DGAT1
SCHEMBL4553845 0.82 DGAT1 (0.45) USP30DGAT1
SCHEMBL1922366 0.79 DGAT1 (0.33) SNCADGAT1
SCHEMBL2099862 0.76 DGAT1 (0.34) DGAT1
SCHEMBL4165224 0.74 CXCR4 (0.34) SNCADGAT1
SCHEMBL14674020 0.71 SNCA (0.36) SNCA
SCHEMBL8083423 0.69 TSHR (0.41) SNCA
SCHEMBL4264297 0.69 SNCA (0.44) SNCA
SCHEMBL2099860 0.69 DGAT1 (0.34) USP30DGAT1

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-8957215-B2 Heteroaryl substituted benzothiazoles NAVIDEA BIOPHARMACEUTICALS, INC. (US) 2015-02-17 US disclosed
US-20120207679-A1 Novel Heteroaryl Substituted Benzothiazoles ASTRAZENECA AB (SE) 2012-08-16 US disclosed
US-20090028787-A1 Novel Heteroaryl Substituted Benzothiazoles NAVIDEA BIOPHARMACEUTICALS, INC. 2009-01-29 US disclosed
EP-1981883-A1 NOVEL HETEROARYL SUBSTITUTED BENZOTHIAZOLES AstraZeneca AB (SE) 2008-10-22 EP disclosed
WO-2007086800-A1 NOVEL HETEROARYL SUBSTITUTED BENZOTHIAZOLES ASTRAZENECA AB (SE) 2007-08-02 WO 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-20090028787-A1 Novel Heteroaryl Substituted Benzothiazoles APP, MAPT, PSEN1 SNCA 102/4885USP30 3199/4885DGAT1 1170/4885
US-20120207679-A1 Novel Heteroaryl Substituted Benzothiazoles MAPT, APP, PSEN1 SNCA 68/4885USP30 3529/4885DGAT1 1644/4885

“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.