SCHEMBL2846689

SCHEMBL2846689

COC[C@H]1CCCN1C(=O)c1cc(C)cc(C(=O)NC(Cc2cc(F)cc(F)c2)C(O)[C@H]2C[C@@H](Oc3ccccc3)CN2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 1.00
BACE2 Q9Y5Z0 4/20 1.00
CTSD P07339 3/20 0.67
CTSE P14091 3/20 0.67

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
SCHEMBL719403 1.00 BACE1 (1.00) BACE1BACE2CTSDCTSE
SCHEMBL719404 1.00 BACE1 (1.00) BACE1BACE2CTSDCTSE
SCHEMBL719405 1.00 BACE1 (1.00) BACE1BACE2CTSDCTSE
SCHEMBL12854707 0.95 BACE1 (1.00) BACE1BACE2CTSDCTSE
SCHEMBL13340996 0.95 BACE1 (1.00) BACE1BACE2CTSDCTSE
SCHEMBL14457271 0.93 BACE1 (0.88) BACE1BACE2CTSDCTSE
SCHEMBL12854709 0.92 BACE1 (0.84) BACE1BACE2CTSDCTSE
SCHEMBL12854698 0.92 BACE1 (0.84) BACE1BACE2CTSDCTSE
SCHEMBL14457268 0.89 BACE1 (0.89) BACE1BACE2CTSDCTSE
SCHEMBL12854711 0.88 BACE1 (0.79) BACE1BACE2CTSDCTSE

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-20100130537-A1 CINNAMIDE COMPOUNDS FOR DEMENTIA EISAI R&D MANAGEMENT CO., LTD (JP) 2010-05-27 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-20100130537-A1 CINNAMIDE COMPOUNDS FOR DEMENTIA GRIN1, GRIN2A, GRIN3A BACE1 9/4885BACE2 40/4885CTSD 477/4885

“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.