SCHEMBL8522343

SCHEMBL8522343

C#COCn1cnc2c(=O)[nH]c(NC(C)=O)nc21

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.70
KMT2A Q03164 3/20 0.70
TSHR P16473 2/20 0.70
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
PNP P00491 3/20 0.46
HBB P68871 2/20 0.46
BLM P54132 2/20 0.46
USP2 O75604 1/20 0.46
EDNRA P25101 1/20 0.46
HTR2A P28223 1/20 0.46
RECQL P46063 1/20 0.46
HSD17B10 Q99714 1/20 0.46
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
HPRT1 P00492 2/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL8444939 0.84 MEN1 (0.80) MEN1KMT2ATSHRTAS1R3TAS1R1
SCHEMBL14421454 0.83 MEN1 (0.69) MEN1KMT2ATSHRTAS1R3TAS1R1
SCHEMBL9021892 0.83 TSHR (0.81) MEN1KMT2ATSHRTAS1R3TAS1R1
SCHEMBL7819447 0.83 MEN1 (1.00) MEN1KMT2ATSHRTAS1R3TAS1R1
SCHEMBL14963622 0.81 KMT2A (0.66) MEN1KMT2ATSHRTAS1R3TAS1R1
SCHEMBL2576527 0.81 MEN1 (0.66) MEN1KMT2ATSHRTAS1R3TAS1R1
SCHEMBL28942682 0.81 TSHR (0.65) MEN1KMT2ATSHRTAS1R3TAS1R1
SCHEMBL8447491 0.80 MEN1 (0.83) MEN1KMT2ATSHRTAS1R3TAS1R1
SCHEMBL8446145 0.80 MEN1 (0.67) MEN1KMT2ATSHRTAS1R3TAS1R1
SCHEMBL14383601 0.79 TSHR (0.72) MEN1KMT2ATSHRTAS1R3TAS1R1

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
EP-0665229-B1 Process for the production of nucleic acid base derivatives AJINOMOTO KK (JP) 1999-11-17 EP claimed