SCHEMBL4030743

SCHEMBL4030743

NC(=O)c1nc(C(=O)O)c[nH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
TSHR P16473 3/20 0.37
ALOX15 P16050 2/20 0.37
KDM4E B2RXH2 2/20 0.37
ACMSD Q8TDX5 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ADORA3 P0DMS8 1/20 0.36
MC4R P32245 1/20 0.36
ADRA1A P35348 1/20 0.36
MC3R P41968 1/20 0.36
HIF1A Q16665 1/20 0.35
SIRT6 Q8N6T7 2/20 0.35
ALDH1A1 P00352 1/20 0.33
KDM5A P29375 1/20 0.32
JMJD1C Q15652 1/20 0.32
KDM3A Q9Y4C1 1/20 0.32
HCAR2 Q8TDS4 2/20 0.31
DAO P14920 1/20 0.31
GDA Q9Y2T3 1/20 0.31
PIM1 P11309 1/20 0.31

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
SCHEMBL3821371 0.89 LMNA (0.41) LMNATSHRADORA3MC4RADRA1A
SCHEMBL8698385 0.85 LMNA (0.39) LMNATSHRALOX15KDM4EACMSD
SCHEMBL87944 0.85 ALOX15 (0.41) LMNATSHRALOX15KDM4EACMSD
SCHEMBL27627380 0.82 LMNA (0.36) LMNATSHRADORA3MC4RADRA1A
SCHEMBL29954040 0.79 KDM4E (0.37) LMNATSHRALOX15KDM4EACMSD
Pyrrole SCHEMBL5232814 0.79 LMNA (0.34) LMNAALDH1A1PIM1
SCHEMBL311179 0.78 KDM4E (0.35) LMNATSHRALOX15KDM4EACMSD
SCHEMBL5806554 0.77 MAPK1 (0.40) TSHRKDM4ESIRT6ALDH1A1
SCHEMBL3706189 0.75 KDM4E (0.42) LMNATSHRKDM4ETDP1ALDH1A1
SCHEMBL161337 0.74

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-1534686-B1 NF-KB INHIBITORS AND USES THEREOF UNIV MICHIGAN STATE (US) 2009-05-20 EP disclosed