SCHEMBL7525593

SCHEMBL7525593

CC(C)(COC(=O)C(C)(C)C)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
ALDH1A1 P00352 1/20 0.39
SNCA P37840 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
HDAC4 P56524 1/20 0.38
GAA P10253 2/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPK14 Q16539 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL7527282 0.88 CES2 (0.42) CES2CES1L3MBTL1ALDH1A1SNCA
SCHEMBL7529687 0.87 ALDH1A1 (0.42) CES2CES1L3MBTL1ALDH1A1SNCA
SCHEMBL7529260 0.87 CES2 (0.41) CES2CES1L3MBTL1ALDH1A1SNCA
SCHEMBL7532764 0.86 ALDH1A1 (0.44) CES2CES1L3MBTL1ALDH1A1SNCA
SCHEMBL7528950 0.86 L3MBTL1 (0.42) CES2CES1L3MBTL1ALDH1A1SNCA
SCHEMBL6415999 0.85 CES2 (0.45) CES2CES1L3MBTL1ALDH1A1SNCA
SCHEMBL7525508 0.85 CES2 (0.40) CES2CES1L3MBTL1ALDH1A1SNCA
SCHEMBL7525193 0.85 CES2 (0.40) CES2CES1L3MBTL1ALDH1A1SNCA
SCHEMBL7522596 0.84 F2R (0.39) CES2CES1L3MBTL1ALDH1A1SNCA
SCHEMBL7523810 0.84 ALDH1A1 (0.42) CES2CES1L3MBTL1ALDH1A1SNCA

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