SCHEMBL7119239

SCHEMBL7119239

CCc1cccc(CNC[C@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(=O)CC2CCS(=O)(=O)C2)c1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.55
CTSD P07339 4/20 0.55
CTSB P07858 13/20 0.55

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
SCHEMBL3350578 1.00 BACE1 (0.55) BACE1CTSDCTSB
SCHEMBL3350575 0.92 BACE1 (0.55) BACE1CTSDCTSB
SCHEMBL3350580 0.92 BACE1 (0.55) BACE1CTSDCTSB
SCHEMBL3349636 0.90 BACE1 (0.61) BACE1CTSDCTSB
SCHEMBL3349632 0.90 BACE1 (0.61) BACE1CTSDCTSB
SCHEMBL3349754 0.88 BACE1 (0.59) BACE1CTSDCTSB
SCHEMBL3349762 0.88 BACE1 (0.59) BACE1CTSDCTSB
SCHEMBL7120227 0.87 BACE1 (0.56) BACE1CTSDCTSB
SCHEMBL3351029 0.87 BACE1 (0.56) BACE1CTSDCTSB
SCHEMBL3355764 0.87 BACE1 (0.58) BACE1CTSDCTSB

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-20030109559-A1 N-(3-amino-2-hydroxy-propyl)substituted alkylamide compounds PHARMACIA & UPJOHN COMPANY 2003-06-12 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-20030109559-A1 N-(3-amino-2-hydroxy-propyl)substituted alkylamide compounds BACE1, APP, BACE2 BACE1 1/4885CTSD 231/4885CTSB 101/4885

“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.