SCHEMBL2284146

SCHEMBL2284146

O=C(CNC1=NC(c2cccc(Br)c2)(c2ccc(OC(F)F)c(Cl)c2)CO1)c1ccc(OC(F)F)c(Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.35
MEN1 O00255 6/20 0.35
KMT2A Q03164 6/20 0.35
HTT P42858 5/20 0.35
NPSR1 Q6W5P4 2/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 5/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.34
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
PDE4A P27815 8/20 0.33
PDE4D Q08499 7/20 0.33
PDE4B Q07343 6/20 0.33
PDE4C Q08493 6/20 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
SCHEMBL4094545 0.88 BACE1 (0.37) PDE4APDE4DPDE4BPDE4CCTSD
SCHEMBL2284137 0.81 BACE1 (0.42) MAPTMEN1KMT2AHTTNPSR1
SCHEMBL2282409 0.78 BACE1 (0.48) CTSDBACE1
SCHEMBL2282412 0.78 BACE1 (0.48) CTSDBACE1
SCHEMBL3395908 0.77 CTSD (0.32) MAPTMEN1KMT2AHTTNPSR1
SCHEMBL3395902 0.74 BACE1 (0.42) MAPTMEN1KMT2AHTTLMNA
SCHEMBL2284570 0.68 BACE1 (0.52) CTSDBACE1
SCHEMBL2284565 0.68 BACE1 (0.52) CTSDBACE1
SCHEMBL2280403 0.68 BACE1 (0.43) MAPTMEN1KMT2AHTTLMNA
SCHEMBL2280431 0.67 BACE1 (0.48) CTSDBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MAPT 36/4885MEN1 346/4885KMT2A 1424/4885

“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.