SCHEMBL4810071

SCHEMBL4810071

CCC(=O)c1ccc(Oc2ccc(-c3scc(-c4ccccc4Cl)c3CC(=O)O)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 17/20 0.62
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CTSD P07339 1/20 0.39
BACE2 Q9Y5Z0 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.37

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
SCHEMBL4815170 0.90 BACE1 (0.75) BACE1MAPTCTSDBACE2
SCHEMBL4813038 0.89 BACE1 (0.62) BACE1PTGDR2
SCHEMBL4810582 0.87 BACE1 (0.83) BACE1CTSDBACE2
SCHEMBL5804999 0.85 BACE1 (0.59) BACE1MAPTL3MBTL1CTSDBACE2
SCHEMBL4806389 0.82 BACE1 (0.75) BACE1MAPT
SCHEMBL4812110 0.82 BACE1 (0.56) BACE1PTGDR2
SCHEMBL4813230 0.79 BACE1 (0.50) BACE1SMN1; SMN2
SCHEMBL4811510 0.78 BACE1 (0.66) BACE1SMN1; SMN2
SCHEMBL4816021 0.78 BACE1 (0.51) BACE1
SCHEMBL4811686 0.78 BACE1 (0.55) BACE1PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7459567-B2 Substituted thienyl and furyl acylguanidines and methods of their use as beta-secretase modulators WYETH (US) 2008-12-02 US disclosed
WO-2006088694-A1 SUBSTITUTED THIENYL AND FURYL ACYLGUANIDINES AS β-SECRETASE MODULATORS WYETH (US) 2006-08-24 WO disclosed
US-20060183792-A1 Substituted thienyl and furyl acylguanidines and methods of their use as beta-secretase modulators WYETH (US) 2006-08-17 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-20060183792-A1 Substituted thienyl and furyl acylguanidines and methods of their use as beta-secretase modulators BACE1, BACE2, PSEN1 BACE1 1/4885MAPT 28/4885SMN1; SMN2 1792/4885

“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.