SCHEMBL7608334

SCHEMBL7608334

N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 6/20 0.52
BCHE P06276 5/20 0.52
TACR1 P25103 9/20 0.46
CTSD P07339 2/20 0.43
BACE2 Q9Y5Z0 1/20 0.43
F2 P00734 1/20 0.43
CACNA1F O60840 1/20 0.41
CACNA1D Q01668 1/20 0.41
CACNA1S Q13698 1/20 0.41
CACNA1C Q13936 1/20 0.41

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
SCHEMBL8276492 0.91 BACE1 (0.62) BACE1BCHECTSDBACE2
SCHEMBL3455222 0.91 BACE1 (0.62) BACE1BCHECTSDBACE2
SCHEMBL161260 0.91 BACE1 (0.62) BACE1BCHECTSDBACE2
Hydrochloric Acid SCHEMBL2499284 0.90 BACE1 (0.61) BACE1BCHECTSDBACE2
SCHEMBL3353556 0.88 BCHE (0.50) BACE1BCHEF2
Formic Acid SCHEMBL5928562 0.87 BACE1 (0.60) BACE1BCHECTSDBACE2
SCHEMBL2605624 0.83 BCHE (0.61) BACE1BCHEF2
SCHEMBL7951036 0.83 BCHE (0.61) BACE1BCHEF2
SCHEMBL496172 0.83 BCHE (0.61) BACE1BCHEF2
SCHEMBL3353939 0.83 BCHE (0.61) BACE1BCHEF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020128255-A1 Compounds to treat alzheimer's disease PHARMACIA & UPJOHN COMPANY 2002-09-12 US claimed

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-20020128255-A1 Compounds to treat alzheimer's disease PSEN2, PSEN1, APP BACE1 4/4885BCHE 12/4885TACR1 758/4885

“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.