SCHEMBL13137992

SCHEMBL13137992

CCCS(=O)(=O)CC1CC(CNC(=O)c2cnc(C)nc2C)(CC2CC2)C1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 20/20 0.44
CYP2C9 P11712 1/20 0.35

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
SCHEMBL13137987 1.00 SLC6A9 (0.44) SLC6A9CYP2C9
SCHEMBL8243232 0.88 SLC6A9 (0.39) SLC6A9
SCHEMBL13137911 0.88 SLC6A9 (0.39) SLC6A9
SCHEMBL13137990 0.88 SLC6A9 (0.39) SLC6A9CYP2C9
SCHEMBL13138010 0.88 SLC6A9 (0.39) SLC6A9CYP2C9
SCHEMBL13138006 0.88 SLC6A9 (0.39) SLC6A9CYP2C9
SCHEMBL13137980 0.86 SLC6A9 (0.47) SLC6A9
SCHEMBL13137991 0.85 SLC6A9 (0.44) SLC6A9CYP2C9
SCHEMBL13137989 0.85 SLC6A9 (0.44) SLC6A9CYP2C9
SCHEMBL13137997 0.83 SLC6A9 (0.51) SLC6A9CYP2C9

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-20100222317-A1 Azetidine Derivatives as GlyT1 Inhibitors MERCK SHARP & DOHME LIMITED (GB) 2010-09-02 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-20100222317-A1 Azetidine Derivatives as GlyT1 Inhibitors GRIA1, GLRA1, GRIN1 SLC6A9 18/4885CYP2C9 496/4885

“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.