SCHEMBL7007073

SCHEMBL7007073

O=c1nc(SCc2ccccc2)[nH]cc1Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 6/20 0.49
XDH P47989 1/20 0.47
MAOB P27338 1/20 0.47
SCN9A Q15858 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
TSHR P16473 1/20 0.46
GFER P55789 1/20 0.46
DAO P14920 1/20 0.46
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
PNP P00491 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43

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
SCHEMBL4423255 0.92 CTSB (0.54) PLA2G7XDHMAOBMAPTRAB9A
SCHEMBL4416264 0.84 PLA2G7 (0.50) PLA2G7
SCHEMBL10048197 0.84 ADORA2A (0.50) PLA2G7TSHRALDH1A1PNPSMN1; SMN2
SCHEMBL7011031 0.83 PLA2G7 (0.50) PLA2G7XDHMAOBGFERDAO
SCHEMBL7004571 0.83 SMN1; SMN2 (0.47) PLA2G7XDHMAOBSCN9AMAPT
SCHEMBL4415189 0.80 PLA2G7 (0.45) PLA2G7MAOBSCN9AMAPTDAO
SCHEMBL6623681 0.78 RAB9A (0.47) PLA2G7XDHMAOBSCN9AMAPT
SCHEMBL15215744 0.75 ADORA2A (0.54) PLA2G7DAOPNPSMN1; SMN2ADORA2A
SCHEMBL3545054 0.74 LMNA (0.50) PLA2G7MAOBMAPTPKMGFER
SCHEMBL4949022 0.73 MAOB (0.48) PLA2G7MAOBMAPTPKMGFER

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1028955-B1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BEECHAM PLC (GB) 2003-07-16 EP claimed
US-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them HICKEY DEIRDRE MARY BERNADETTE (GB) 2002-08-29 US claimed
EP-1028955-A1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SmithKline Beecham p.l.c. (GB) 2000-08-23 EP claimed
WO-1999024420-A1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BEECHAM PLC (GB) 1999-05-20 WO claimed
US-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them HICKEY DEIRDRE MARY BERNADETTE (GB) 2002-08-29 US disclosed
US-6417192-B1 DRUGS WITH PYRIMIDONE COMPOUNDS INHIBITORS OF THE ENZYME LDL PLA.SUB.2 AND THEREFORE OF USE IN TREATING ATHEROSCLEROSIS. SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-09 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 1/4885XDH 232/4885MAOB 486/4885

“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.