SCHEMBL7528084

SCHEMBL7528084

CC(C)(COP(=O)(O)O)NC(=O)c1ccc(F)cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
SNCA P37840 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
RIPK1 Q13546 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HDAC4 P56524 1/20 0.38
S1PR4 O95977 2/20 0.37
S1PR1 P21453 2/20 0.37
S1PR3 Q99500 2/20 0.37
S1PR5 Q9H228 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL6415999 0.85 CES2 (0.45) CES2CES1L3MBTL1SNCACNR1
SCHEMBL6418339 0.83 KDM4E (0.51) CES2CES1L3MBTL1SNCACNR1
SCHEMBL7527282 0.83 CES2 (0.42) CES2CES1L3MBTL1SNCACNR1
SCHEMBL7525593 0.82 CES2 (0.41) CES2CES1L3MBTL1SNCACNR1
SCHEMBL7529687 0.82 ALDH1A1 (0.42) CES2CES1L3MBTL1SNCACNR1
SCHEMBL7529260 0.82 CES2 (0.41) CES2CES1L3MBTL1SNCACNR1
SCHEMBL7532764 0.81 ALDH1A1 (0.44) CES2CES1L3MBTL1SNCACNR1
SCHEMBL7528950 0.81 L3MBTL1 (0.42) CES2CES1L3MBTL1SNCACNR1
SCHEMBL6419694 0.80 CNR2 (0.54) CES2CES1L3MBTL1SNCACNR1
SCHEMBL6419870 0.80 CES2 (0.49) CES2CES1L3MBTL1SNCACNR1

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-1184367-A1 AMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-03-06 EP disclosed