SCHEMBL3349168

SCHEMBL3349168

COc1nc2ccc(F)c([C@H](O)CNC(=O)OC(C)(C)C)c2nc1OC

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 1/20 0.35
GFER P55789 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
PCSK9 Q8NBP7 1/20 0.35
BRD4 O60885 5/20 0.34
MAPT P10636 1/20 0.34
CTSS P25774 2/20 0.33
CTSK P43235 2/20 0.33
EGFR P00533 1/20 0.33
AURKB Q96GD4 1/20 0.33
BCHE P06276 1/20 0.33
SYK P43405 1/20 0.33
DYRK1A Q13627 1/20 0.33

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
SCHEMBL1712463 0.85 KCNH2 (0.37) GFERHSD17B10L3MBTL1KDM4ENPC1
SCHEMBL1712060 0.82 MTNR1A (0.40) SERPINE1GFERHSD17B10L3MBTL1KDM4E
SCHEMBL2291901 0.81 TRPA1 (0.36) KDM4ECTSSCTSK
SCHEMBL2289801 0.76 HSD17B1 (0.32)
SCHEMBL1711831 0.76 ALDH1A1 (0.33) HSD17B10KDM4ERAB9AMAPTCTSS
SCHEMBL31559761 0.74 DRD2 (0.38) SERPINE1PCSK9EGFRAURKBSYK
SCHEMBL24214779 0.71 STK17B (0.37) SERPINE1GFERHSD17B10L3MBTL1KDM4E
SCHEMBL1711953 0.70 MTNR1A (0.39) PCSK9SYK
SCHEMBL7218145 0.69 ADRB1 (0.43) SERPINE1HSD17B10KDM4ENPC1RAB9A
SCHEMBL1712486 0.69 MTNR1A (0.39) SERPINE1GFERHSD17B10L3MBTL1PCSK9

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
WO-2010041194-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2010-04-15 WO disclosed