SCHEMBL2768617

SCHEMBL2768617

CC(C)(C)[C@@H](c1cc(Cl)c2c(c1)OCO2)C(NC(=O)O)C(=O)c1nccs1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 16/20 0.39
POLB P06746 1/20 0.33
CASP6 P55212 1/20 0.33
HSPA9 P38646 1/20 0.32

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
SCHEMBL1798771 0.83 CNR2 (0.36) GRM5POLB
SCHEMBL1799872 0.79 CNR2 (0.35) GRM5
SCHEMBL1797443 0.77 CMA1 (0.38) GRM5POLBCASP6
SCHEMBL1799693 0.72 CTSK (0.36)
SCHEMBL1799689 0.72 CTSK (0.36)
SCHEMBL2768616 0.72 MAPK8 (0.33) POLBCASP6
SCHEMBL1801475 0.67 CNR2 (0.34)
SCHEMBL1794725 0.67 MAPK8 (0.35) POLBCASP6
SCHEMBL5126789 0.65 CTSK (0.36)
SCHEMBL3306590 0.63 ALDH1A1 (0.50) GRM5HSPA9

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-7803809-B2 Substituted pyrano [2,3-b] pyridinamine compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2010-09-28 US disclosed
US-20100120774-A1 Substituted Pyrano [2,3-b] Pyridinamine compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2010-05-13 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-20100120774-A1 Substituted Pyrano [2,3-b] Pyridinamine compounds as beta-secretase modulators and methods of use BACE1, APP, BACE2 GRM5 466/4885POLB 2083/4885CASP6 1662/4885

“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.