SCHEMBL2283709

SCHEMBL2283709

COc1cccc(-c2cccc(C3(c4ccccc4)COC(NOC=O)=N3)c2)c1F

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 17/20 0.47
CTSD P07339 6/20 0.43
APP P05067 1/20 0.38
ERN1 O75460 1/20 0.37
CTSA P10619 1/20 0.34

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
SCHEMBL2288115 0.94 BACE1 (0.51) BACE1CTSDAPPERN1
SCHEMBL2281336 0.88 BACE1 (0.41) BACE1CTSDAPPERN1
SCHEMBL2283475 0.85 BACE1 (0.55) BACE1CTSDAPP
SCHEMBL2284115 0.82 BACE1 (0.52) BACE1CTSD
SCHEMBL2284002 0.81 BACE1 (0.47) BACE1CTSD
Formic Acid SCHEMBL2283704 0.81 BACE1 (0.58) BACE1CTSDAPPERN1
SCHEMBL2284379 0.81 BACE1 (0.56) BACE1CTSD
SCHEMBL2286980 0.81 BACE1 (0.69) BACE1CTSD
SCHEMBL2284078 0.81 BACE1 (0.39) BACE1CTSDAPPERN1
SCHEMBL7871492 0.81 BACE1 (0.63) BACE1CTSDAPP

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
EP-2245019-B1 4, 5-DIHYDRO-OXAZOL-2-YL AMINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2012-11-14 EP disclosed
US-7989449-B2 4,5-dihydro-oxazol-2-yl amine derivatives HOFFMAN-LA ROCHE INC. (US) 2011-08-02 US disclosed
US-20090209529-A1 4,5-DIHYDRO-OXAZOL-2-YL AMINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-08-20 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-20090209529-A1 4,5-DIHYDRO-OXAZOL-2-YL AMINE DERIVATIVES BACE2, BACE1, PSEN2 BACE1 2/4885CTSD 721/4885APP 4/4885

“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.