SCHEMBL4848422

SCHEMBL4848422

CCc1nc(CP(=O)(O)O)cs1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 3/20 0.44
PGK2 P07205 3/20 0.44
SLC6A3 Q01959 1/20 0.42
PDE10A Q9Y233 1/20 0.34
BCHE P06276 2/20 0.33
FDPS P14324 1/20 0.33
PDE8B O95263 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
SCHEMBL20536453 0.84 PGK1 (0.46) PGK1PGK2FDPS
SCHEMBL8121663 0.81 PGK1 (0.41) PGK1PGK2BCHE
SCHEMBL20536552 0.81 PGK1 (0.43) PGK1PGK2
SCHEMBL3556536 0.78 PGK1 (0.47) PGK1PGK2SLC6A3
SCHEMBL2256127 0.76
SCHEMBL20536570 0.76 PGK1 (0.39) PGK1PGK2
SCHEMBL20535750 0.76 PGK1 (0.36) PGK1PGK2BCHE
SCHEMBL8219198 0.75
SCHEMBL20536064 0.74 PGK1 (0.38) PGK1PGK2
Hydrochloric Acid SCHEMBL10988638 0.74 SLC6A3 (0.46) SLC6A3PDE10APDE8B

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-7368578-B2 Five-membered heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-06 US disclosed
US-20060135578-A1 Five-membered heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-22 US disclosed
EP-1541564-A1 FIVE-MEMBERED HETEROCYCLIC COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2005-06-15 EP 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-20060135578-A1 Five-membered heterocyclic compounds GPR119, OR10J3, CYP11B1 PGK1 3240/4885PGK2 3966/4885SLC6A3 2800/4885

“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.