SCHEMBL7606149

SCHEMBL7606149

CCCN(CCC)C(=O)c1cc(C)cc(C(=O)NC(Cc2cc(F)cc(F)c2)[C@H](O)CNCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.78
BACE2 Q9Y5Z0 5/20 0.78
CTSD P07339 4/20 0.77

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
SCHEMBL5344920 1.00 BACE1 (0.78) BACE1BACE2CTSD
SCHEMBL5348605 0.93 BACE1 (0.88) BACE1BACE2CTSD
SCHEMBL5354471 0.92 BACE1 (0.87) BACE1BACE2CTSD
SCHEMBL3350930 0.92 BACE1 (0.86) BACE1BACE2CTSD
SCHEMBL5346831 0.92 BACE1 (0.85) BACE1BACE2CTSD
SCHEMBL3351026 0.89 BACE1 (0.76) BACE1BACE2CTSD
SCHEMBL5376347 0.88 BACE1 (0.65) BACE1BACE2CTSD
SCHEMBL3904992 0.88 BACE1 (0.88) BACE1BACE2CTSD
SCHEMBL3349454 0.87 BACE1 (1.00) BACE1BACE2CTSD
SCHEMBL3348990 0.87 BACE1 (1.00) BACE1BACE2CTSD

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 4/4885BACE2 9/4885CTSD 2080/4885

“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.