SCHEMBL6415409

SCHEMBL6415409

CC(O)c1csc(-c2ccccc2NC(=O)OCC2CCN(C(=O)OC(C)(C)C)CC2)n1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 1/20 0.45
BRAF P15056 1/20 0.45
CHRM3 P20309 19/20 0.44

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
SCHEMBL6415415 1.00 RAF1 (0.45) RAF1BRAFCHRM3
SCHEMBL6224224 0.94 RAF1 (0.45) RAF1BRAFCHRM3
SCHEMBL6227417 0.92 CHRM3 (0.45) RAF1BRAFCHRM3
SCHEMBL6415265 0.89 CHRM3 (0.50) CHRM3
SCHEMBL6229269 0.89 RAF1 (0.45) RAF1BRAFCHRM3
SCHEMBL6227746 0.88 CHRM3 (0.47) RAF1BRAFCHRM3
SCHEMBL6416937 0.88 CHRM3 (0.49) RAF1BRAFCHRM3
SCHEMBL6226880 0.88 CHRM3 (0.50) RAF1BRAFCHRM3
SCHEMBL6415573 0.88 CHRM3 (0.49) RAF1BRAFCHRM3
SCHEMBL6227008 0.87 CHRM3 (0.47) RAF1BRAFCHRM3

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-20050277676-A1 M3muscarinic acetylcholine receptor antagonists GLAXO GROUP LIMITED (GB) 2005-12-15 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-20050277676-A1 M3muscarinic acetylcholine receptor antagonists CHRM3, CHRM2, CHRM5 RAF1 4293/4885BRAF 4577/4885CHRM3 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.