SCHEMBL7564706

SCHEMBL7564706

O=c1[nH]c(=S)n(CCCO)cc1Cc1cccnc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 12/20 0.42
UPP1 Q16831 1/20 0.41
PNP P00491 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
PKM P14618 1/20 0.38
MAPK10 P53779 1/20 0.38

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
SCHEMBL7005777 0.86 PLA2G7 (0.38) PLA2G7UPP1
SCHEMBL7007222 0.86 UPP1 (0.55) UPP1HPGD
SCHEMBL7007609 0.82 PLA2G7 (0.46) PLA2G7PNPPKMMAPK10
SCHEMBL7004509 0.81 PLA2G7 (0.38) PLA2G7UPP1
SCHEMBL7009380 0.80 PKM (0.48) PLA2G7UPP1GAAPKMMAPK10
SCHEMBL7013517 0.79 PKM (0.45) PLA2G7PNPGAAHPGDPKM
SCHEMBL7005535 0.78 UPP1 (0.38) PLA2G7UPP1
SCHEMBL7013677 0.78 UPP1 (0.57) UPP1HPGD
SCHEMBL7004030 0.77 PLA2G7 (0.57) PLA2G7
SCHEMBL7006845 0.76 PLA2G7 (0.45) PLA2G7PNPPKMMAPK10

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-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them HICKEY DEIRDRE MARY BERNADETTE (GB) 2002-08-29 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-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them PLA2G7, PLA2G1B, PLA2G4C PLA2G7 1/4885UPP1 79/4885PNP 24/4885

“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.