SCHEMBL3425836

SCHEMBL3425836

Cc1[nH]c(C)c(-c2ccc(-c3ccc(C=O)cc3)nc2)c(=O)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.37
SLC2A1 P11166 2/20 0.35
BRD4 O60885 1/20 0.33
DGAT1 O75907 1/20 0.31
CYP2A6 P11509 1/20 0.30
HSD17B10 Q99714 1/20 0.30
HPGDS O60760 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MITF O75030 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
KLF5 Q13887 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL4478739 0.87 SLC2A1 (0.47) SLC2A1BRD4KDM4EALDH1A1SMN1; SMN2
SCHEMBL13754687 0.86 HPGDS (0.43) SLC2A1DGAT1HSD17B10HPGDSKDM4E
SCHEMBL4475363 0.85 NPC1 (0.40) SLC2A1
SCHEMBL4481800 0.82 RXFP1 (0.45) SLC2A1BRD4DGAT1ALDH1A1HPGD
SCHEMBL3392235 0.81 KDM1A (0.39) SLC2A1DGAT1SMN1; SMN2
SCHEMBL4565033 0.81 SLC2A1 (0.43) SLC2A1DGAT1KDM4E
SCHEMBL4483589 0.81 SLC2A1 (0.34) SLC2A1DGAT1
SCHEMBL4490539 0.79 KDM1A (0.41) SLC2A1SMN1; SMN2
SCHEMBL4490712 0.79 SLC2A1 (0.40) SLC2A1DGAT1
Hydrochloric Acid SCHEMBL4489660 0.78 DGAT1 (0.39) SLC2A1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2246329-A1 4(1H)-pyridinone derivatives and their use as antimalaria agents Glaxo Group Limited (GB) 2010-11-03 EP disclosed
EP-2246329-A1 4(1H)-pyridinone derivatives and their use as antimalaria agents Glaxo Group Limited (GB) 2010-11-03 EP disclosed
WO-2010081904-A1 4 ( 1H) -PYRIDINONE DERIVATIVES AND THEIR USE AS ANTIMALARIA AGENTS GLAXO GROUP LIMITED (GB) 2010-07-22 WO disclosed
WO-2010081904-A1 4 ( 1H) -PYRIDINONE DERIVATIVES AND THEIR USE AS ANTIMALARIA AGENTS GLAXO GROUP LIMITED (GB) 2010-07-22 WO disclosed