SCHEMBL17620792

SCHEMBL17620792

COc1cc(F)c2c(c1)[C@]1(CCSC(N(C(=O)O)C(C)(C)C)=N1)c1cc(Br)ccc1O2

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.49
CTSD P07339 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
SCHEMBL17620793 1.00 BACE1 (0.49) BACE1CTSD
SCHEMBL16108842 0.82 BACE1 (0.55) BACE1CTSD
SCHEMBL2523510 0.80 BACE1 (0.62) BACE1CTSD
SCHEMBL14823703 0.80 BACE1 (0.62) BACE1CTSD
SCHEMBL16139658 0.80 BACE1 (0.52) BACE1CTSD
SCHEMBL2518641 0.79 BACE1 (0.54) BACE1CTSD
SCHEMBL12212516 0.74 BACE1 (0.43) BACE1CTSD
SCHEMBL12236615 0.74 BACE1 (0.44) BACE1CTSD
SCHEMBL2372218 0.74 BACE1 (0.44) BACE1CTSD
SCHEMBL2523497 0.73 BACE1 (0.39) BACE1CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9777019-B2 Amino-oxazine and amino-dihydrothiazine compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2017-10-03 US disclosed
US-20160159818-A1 Amino-Oxazine and Amino-Dihydrothiazine Compounds as Beta-Secretase Modulators and Methods of Use AMGEN INC. (US) 2016-06-09 US disclosed
US-9296759-B2 Amino-oxazine and amino-dihydrothiazine compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2016-03-29 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 (1 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-20160159818-A1 Amino-Oxazine and Amino-Dihydrothiazine Compounds as Beta-Secretase Modulators and Methods of Use BACE1, APP, BACE2 BACE1 1/4885CTSD 2039/4885

“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.