SCHEMBL2284409

SCHEMBL2284409

COc1ccc(C2(c3cccc(-c4cncc(F)c4)c3)COC(NOC=O)=N2)cc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 14/20 0.43
CTSD P07339 6/20 0.43
BACE2 Q9Y5Z0 3/20 0.43
CYP11B2 P19099 1/20 0.33
HTR2A P28223 5/20 0.32
HTR2C P28335 5/20 0.32
HTR2B P41595 5/20 0.32
CYP1A2 P05177 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
GMNN O75496 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32

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
SCHEMBL2283154 0.92 BACE1 (0.43) BACE1CTSDBACE2HTR2AHTR2C
SCHEMBL2284118 0.91 BACE1 (0.49) BACE1CTSDBACE2HTR2AHTR2C
SCHEMBL2281059 0.91 BACE1 (0.53) BACE1CTSDBACE2HTR2AHTR2C
SCHEMBL2283698 0.90 BACE1 (0.43) BACE1CTSDBACE2CYP1A2KCNH2
SCHEMBL2281340 0.87 BACE1 (0.48) BACE1CTSDBACE2MAPTTSHR
SCHEMBL2279854 0.87 BACE1 (0.53) BACE1CTSDBACE2KCNH2
SCHEMBL2282303 0.86 BACE1 (0.41) BACE1CTSDBACE2KCNH2
SCHEMBL2282646 0.85 BACE1 (0.42) BACE1CTSDBACE2KCNH2
Formic Acid SCHEMBL2284406 0.84 BACE1 (0.52) BACE1CTSDBACE2KCNH2
SCHEMBL2281067 0.84 BACE1 (0.41) BACE1CTSDBACE2HTR2AHTR2C

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 721/4885BACE2 1/4885

“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.