SCHEMBL30088415

SCHEMBL30088415

CC(C)(C)[S@@+]([O-])N[C@@](C)(C[C@H](O[Si](C)(C)C)C(F)(F)F)c1nc(Br)ccc1F

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.34

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
SCHEMBL16166099 1.00 BACE1 (0.34) BACE1
SCHEMBL16166100 1.00 BACE1 (0.34) BACE1
SCHEMBL16166021 0.88 BACE1 (0.32) BACE1
SCHEMBL16166022 0.88 BACE1 (0.32) BACE1
SCHEMBL17511226 0.88 BACE1 (0.32) BACE1
SCHEMBL17511227 0.88 BACE1 (0.32) BACE1
SCHEMBL15991873 0.84 BACE1 (0.36) BACE1
SCHEMBL15991872 0.84 BACE1 (0.36) BACE1
SCHEMBL16166164 0.84 BACE1 (0.36) BACE1
SCHEMBL16166162 0.84 BACE1 (0.36) BACE1

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-11447478-B2 BACE1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2022-09-20 — — 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-11447478-B2 BACE1 inhibitors BACE1, BACE2, APP BACE1 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.

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