SCHEMBL2818140

SCHEMBL2818140

CC(C)(C)OC(=O)NC(O)CCc1cccc(N(CCCCCOCc2ccccc2)C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
PPARA Q07869 2/20 0.43
PPARG P37231 1/20 0.40
CTSS P25774 2/20 0.40
CTSK P43235 2/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL2178104 0.84 CTSK (0.46) PPARAPPARGCTSSCTSK
SCHEMBL2177717 0.81 CTSK (0.45) PPARAPPARGCTSSCTSK
SCHEMBL2818137 0.81 L3MBTL1 (0.46) L3MBTL1PPARACTSSMAPT
SCHEMBL2821042 0.78 CTSK (0.40) CTSSCTSK
SCHEMBL3138728 0.78 L3MBTL1 (0.48) L3MBTL1PPARAPPARGCTSSMAPT
SCHEMBL2176308 0.77 L3MBTL1 (0.50) L3MBTL1PPARACTSSMAPT
SCHEMBL28108976 0.74 CTSK (0.62) PPARAPPARGCTSSCTSK
SCHEMBL27730329 0.74 CTSK (0.62) PPARAPPARGCTSSCTSK
SCHEMBL22042132 0.74 CTSK (0.62) PPARAPPARGCTSSCTSK
SCHEMBL8615711 0.71 PPARA (0.69) L3MBTL1PPARAPPARGCTSSCTSK

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-2010048332-A2 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA, INC. (US) 2010-04-29 WO disclosed