SCHEMBL449691

SCHEMBL449691

CC1(C)Cc2ccc(N)cc2C2(CCSC(NC(=O)OC(C)(C)C)=N2)C1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 11/20 0.42
CTSD P07339 4/20 0.42
NR1H2 P55055 1/20 0.32
PSMB8 P28062 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL447140 0.89 BACE1 (0.45) BACE1CTSDPSMB8
SCHEMBL446899 0.86 BACE1 (0.46) BACE1CTSD
SCHEMBL447872 0.81 BACE1 (0.50) BACE1
SCHEMBL450426 0.80 BACE1 (0.45) BACE1
SCHEMBL445893 0.80 BACE1 (0.43) BACE1CTSD
SCHEMBL7934145 0.79 BACE1 (0.38) BACE1
SCHEMBL446250 0.79 BACE1 (0.42) BACE1CTSDNR1H2PSMB8GAA
SCHEMBL2566485 0.78 BACE1 (0.36) BACE1CTSD
SCHEMBL4074715 0.78 BACE1 (0.49) BACE1
SCHEMBL4077651 0.78 BACE1 (0.49) 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 4 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
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
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 2/4885CTSD 427/4885NR1H2 41/4885

“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.