SCHEMBL2283122

SCHEMBL2283122

CCOc1cc(Nc2ccccc2)cc([C@@]2(c3ccc(OC)c(C)c3)COC(N)=N2)c1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 15/20 0.40
CTSD P07339 9/20 0.40
P2RX7 Q99572 2/20 0.35
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL2283110 1.00 BACE1 (0.40) BACE1CTSDP2RX7ALDH1A1KMT2A
SCHEMBL2284561 0.91 BACE1 (0.44) BACE1CTSDALDH1A1KMT2AMEN1
SCHEMBL2284558 0.91 BACE1 (0.44) BACE1CTSDALDH1A1KMT2AMEN1
SCHEMBL2283083 0.91 BACE1 (0.38) BACE1CTSD
SCHEMBL2283087 0.91 BACE1 (0.38) BACE1CTSD
SCHEMBL2287944 0.90 BACE1 (0.39) BACE1CTSDP2RX7KMT2AMEN1
SCHEMBL7871291 0.90 BACE1 (0.41) BACE1CTSD
SCHEMBL2287937 0.90 BACE1 (0.39) BACE1CTSDP2RX7KMT2AMEN1
SCHEMBL2281965 0.87 BACE1 (0.37) BACE1CTSD
SCHEMBL2281960 0.87 BACE1 (0.37) 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 721/4885P2RX7 1120/4885

“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.