SCHEMBL447872

SCHEMBL447872

CC1(C)Cc2ccc(NC(=O)c3ccc(Cl)cn3)cc2C2(CCSC(NC(=O)OC(C)(C)C)=N2)C1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 17/20 0.50
BACE2 Q9Y5Z0 3/20 0.49
APP P05067 2/20 0.42

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
SCHEMBL450426 0.92 BACE1 (0.45) BACE1BACE2APP
SCHEMBL445893 0.85 BACE1 (0.43) BACE1BACE2APP
SCHEMBL445972 0.83 BACE1 (0.68) BACE1BACE2
SCHEMBL447140 0.81 BACE1 (0.45) BACE1
SCHEMBL449691 0.81 BACE1 (0.42) BACE1
SCHEMBL448287 0.80 BACE1 (0.49) BACE1BACE2APP
SCHEMBL2566485 0.79 BACE1 (0.36) BACE1APP
SCHEMBL14551013 0.77 BACE1 (0.59) BACE1BACE2
SCHEMBL14551010 0.77 BACE1 (0.70) BACE1BACE2
SCHEMBL10154564 0.77 BACE1 (0.59) BACE1BACE2APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. 2012-03-15 US disclosed
WO-2011123674-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. (US) 2011-10-06 WO 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-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES APP, BACE1, PSEN1 BACE1 2/4885BACE2 4/4885APP 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.