SCHEMBL3864206

SCHEMBL3864206

CC(C)COC(=O)CNC(=O)C1=C(O)c2cc(Cl)cc(F)c2C(C)(C)C1=O

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 1/20 0.31
ATM Q13315 1/20 0.31
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
MME P08473 1/20 0.30
SCN9A Q15858 2/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
SCN5A Q14524 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
SCHEMBL1627839 0.85 PTPRC (0.38) L3MBTL1MAPT
SCHEMBL1626478 0.84 EGLN1 (0.42)
SCHEMBL12720450 0.84 EGLN1 (0.33)
SCHEMBL3840046 0.78 SPR (0.39) MAPTLMNA
SCHEMBL3837301 0.77 CACNA1F (0.37) TDP1MAPTMAPK1HTT
SCHEMBL1626735 0.75 SPR (0.46) TDP1L3MBTL1MAPTATMLMNA
SCHEMBL3837300 0.74 SPR (0.39) CYP3A4
SCHEMBL3861436 0.74 SPR (0.48) TSHRLMNAMAPK1HTT
SCHEMBL3843024 0.73 SPR (0.38) TSHRHTT
SCHEMBL3864870 0.70 SPR (0.39) TSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2111399-A2 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF Amgen Inc. (US) 2009-10-28 EP disclosed
WO-2008076427-A2 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF AMGEN INC. (US) 2008-06-26 WO disclosed