SCHEMBL1974866

SCHEMBL1974866

CC1(c2cc(N)ccc2Cl)N=C(N)OCC1(F)F

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 9/20 0.50
BACE2 Q9Y5Z0 9/20 0.50
TAAR1 Q96RJ0 1/20 0.48
APP P05067 1/20 0.45

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
SCHEMBL1974862 1.00 BACE1 (0.50) BACE1BACE2TAAR1APP
SCHEMBL1977346 0.85 BACE1 (0.56) BACE1BACE2
SCHEMBL1977348 0.85 BACE1 (0.56) BACE1BACE2
SCHEMBL16900332 0.84 BACE1 (0.44) BACE1BACE2TAAR1
SCHEMBL16900333 0.84 BACE1 (0.45) BACE1BACE2
Hydrochloric Acid SCHEMBL13268453 0.84 BACE1 (0.55) BACE1BACE2
SCHEMBL1974303 0.83 BACE1 (0.48) BACE1BACE2TAAR1APP
SCHEMBL1974300 0.83 BACE1 (0.48) BACE1BACE2TAAR1APP
SCHEMBL13268448 0.83 BACE1 (0.52) BACE1BACE2APP
Formic Acid SCHEMBL14732153 0.79 BACE1 (0.56) BACE1BACE2

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-8389513-B2 2-amino-5,5-difluoro-5,6-dihydro-4H-[1,3]oxazin-4-yl)-phenyl]-amides HOFFMANN-LA ROCHE INC. (US) 2013-03-05 US disclosed
US-20110144097-A1 2-AMINO-5,5-DIFLUORO-5,6-DIHYDRO-4H-[1,3]OXAZIN-4-YL)-PHENYL]-AMIDES F. HOFFMANN-LA ROCHE AG (CH) 2011-06-16 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-20110144097-A1 2-AMINO-5,5-DIFLUORO-5,6-DIHYDRO-4H-[1,3]OXAZIN-4-YL)-PHENYL]-AMIDES BACE2, BACE1, APP BACE1 2/4885BACE2 1/4885TAAR1 3462/4885

“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.