SCHEMBL8124808

SCHEMBL8124808

Cc1nc(SCc2ccccc2)[nH]c(=O)c1Cc1cncnc1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 3/20 0.65
LMNA P02545 1/20 0.62
HSD17B10 Q99714 1/20 0.62
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
TSHR P16473 1/20 0.60
GFER P55789 1/20 0.57
THRB P10828 2/20 0.54
ALDH1A1 P00352 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
MAPT P10636 1/20 0.53
HTT P42858 1/20 0.53
MAOB P27338 1/20 0.51
TP53 P04637 1/20 0.51

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
SCHEMBL20828281 0.90 LMNA (0.74) LMNAHSD17B10MEN1KMT2ATSHR
SCHEMBL8133220 0.88 PLA2G7 (0.67) PLA2G7LMNAHSD17B10MEN1KMT2A
SCHEMBL8133945 0.86 PLA2G7 (0.65) PLA2G7LMNAHSD17B10GFERALDH1A1
SCHEMBL8135226 0.84 PLA2G7 (0.63) PLA2G7GFERALDH1A1SMN1; SMN2HTT
SCHEMBL8139957 0.82 PLA2G7 (0.60) PLA2G7GFERALDH1A1SMN1; SMN2HTT
SCHEMBL7741998 0.82 PLA2G7 (0.60) PLA2G7GFERALDH1A1SMN1; SMN2HTT
SCHEMBL7013476 0.82 PLA2G7 (0.57) PLA2G7KMT2AGFERALDH1A1SMN1; SMN2
SCHEMBL20828282 0.81 MEN1 (0.75) LMNAHSD17B10MEN1KMT2ATSHR
SCHEMBL8139622 0.80 PLA2G7 (0.58) PLA2G7GFERALDH1A1SMN1; SMN2HTT
SCHEMBL8141713 0.80 PLA2G7 (0.58) PLA2G7GFERALDH1A1SMN1; SMN2HTT

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
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