SCHEMBL30165327

SCHEMBL30165327

CC(C)Cc1cc(C(N)=O)nc(=O)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
PARP1 P09874 1/20 0.38
LMNA P02545 1/20 0.37
DAO P14920 1/20 0.37
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 3/20 0.34
KDM4E B2RXH2 3/20 0.34
MAPK1 P28482 2/20 0.34
HSD17B10 Q99714 2/20 0.34
IKBKB O14920 2/20 0.34
XDH P47989 2/20 0.34
HPGD P15428 2/20 0.34
TSHR P16473 2/20 0.33
NQO2 P16083 1/20 0.32
GSK3B P49841 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
EPHX1 P07099 1/20 0.32

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
SCHEMBL23900502 0.86 HCAR2 (0.40) MAPTPARP1DAOTSHRGPR84
SCHEMBL23907987 0.72 FAAH (0.43) MAPTGAAMAPK1
SCHEMBL23900441 0.69 P2RX7 (0.42) MAPT
SCHEMBL23863964 0.67 POLB (0.36) MAPTLMNAPOLBL3MBTL1GAA
SCHEMBL3708249 0.65 LMNA (0.37) PARP1LMNADAOPOLBL3MBTL1
SCHEMBL6366504 0.64 HCAR2 (0.66) DAO
SCHEMBL2791167 0.64 ALDH1A1 (0.56) MAPTLMNAPOLBL3MBTL1KDM4E
SCHEMBL13995850 0.64 HCAR2 (0.47)
SCHEMBL22186341 0.62 PDE3B (0.45) MAPTPARP1DAOPOLBXDH
SCHEMBL16738661 0.62 PDE2A (0.49) LMNA

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-4125845-A1 NOVEL 2-PYRIMIDONE ANALOGS AS POTENT ANTIVIRAL AGENTS AGAINST ALPHAVIRUSES Southern Research Institute (US) 2023-02-08 EP disclosed