SCHEMBL8426360

SCHEMBL8426360

CCN(C(=O)NC)[C@@H]1CCSC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 1/20 0.32
PYGL P06737 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
SCHEMBL8427548 1.00 CCR5 (0.32) CCR5PYGL
SCHEMBL8426463 0.81 DPP4 (0.36) PYGL
SCHEMBL965716 0.80 CCR5 (0.39) CCR5
SCHEMBL969305 0.78 L3MBTL1 (0.41) CCR5
SCHEMBL970246 0.77 L3MBTL1 (0.44) CCR5
SCHEMBL968899 0.75 L3MBTL1 (0.46)
SCHEMBL8239143 0.73
SCHEMBL8248970 0.73
SCHEMBL9008706 0.72 SLC6A4 (0.39) CCR5
SCHEMBL20414687 0.71 CCR5 (0.32) CCR5

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-7446114-B2 Quinolinone compounds as 5-HT4 receptor agonists THERAVANCE, INC. (US) 2008-11-04 US disclosed
US-20060199839-A1 Quinolinone compounds as 5-HT4 receptor agonists THERAVANCE, INC. 2006-09-07 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-20060199839-A1 Quinolinone compounds as 5-HT4 receptor agonists HTR4, HTR5A, HTR1A CCR5 292/4885PYGL 3520/4885

“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.