SCHEMBL2285156

SCHEMBL2285156

COc1ccc(F)c(-c2cccc(C3(c4ccc5c(c4)CCO5)COC(NOC=O)=N3)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 18/20 0.49
CTSD P07339 12/20 0.49
APP P05067 1/20 0.39
BACE2 Q9Y5Z0 1/20 0.35
TNIK Q9UKE5 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
SCHEMBL2281207 0.90 BACE1 (0.41) BACE1CTSDBACE2
SCHEMBL2283475 0.88 BACE1 (0.55) BACE1CTSDAPPTNIK
SCHEMBL2281336 0.87 BACE1 (0.41) BACE1CTSDAPPBACE2
SCHEMBL2283587 0.84 BACE1 (0.43) BACE1CTSDBACE2
Formic Acid SCHEMBL2285148 0.84 BACE1 (0.63) BACE1CTSDAPP
SCHEMBL2281928 0.84 BACE1 (0.69) BACE1CTSDBACE2TNIK
SCHEMBL7870713 0.84 BACE1 (0.69) BACE1CTSDAPP
SCHEMBL2284115 0.84 BACE1 (0.52) BACE1CTSDTNIK
SCHEMBL2283445 0.84 BACE1 (0.51) BACE1CTSDAPPBACE2TNIK
SCHEMBL2285600 0.83 NPC1 (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
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.