SCHEMBL8567700

SCHEMBL8567700

CC(C)(CCOCc1ccccc1)C[C@@H](C=O)NC(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.54
PPARG P37231 1/20 0.49
CTSS P25774 1/20 0.48
CTSK P43235 8/20 0.47
CTSB P07858 3/20 0.46
ATM Q13315 1/20 0.46
CTSL P07711 1/20 0.44
KLK7 P49862 1/20 0.43
KLK5 Q9Y337 1/20 0.43
SYK P43405 1/20 0.43
ACE P12821 1/20 0.43

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
SCHEMBL8567696 1.00 PPARA (0.54) PPARAPPARGCTSSCTSKCTSB
SCHEMBL271394 0.83 PPARA (0.63) PPARAPPARGCTSSCTSKCTSB
SCHEMBL2230694 0.83 PPARA (0.63) PPARAPPARGCTSSCTSKCTSB
SCHEMBL4126013 0.83 PPARA (0.63) PPARAPPARGCTSSCTSKCTSB
SCHEMBL8540382 0.83 CTSK (0.59) PPARAPPARGCTSSCTSKCTSB
SCHEMBL1586917 0.83 PPARA (0.55) PPARAPPARGCTSSCTSKCTSB
SCHEMBL8564724 0.83 PPARA (0.55) PPARAPPARGCTSSCTSKCTSB
SCHEMBL8540381 0.83 CTSK (0.59) PPARAPPARGCTSSCTSKCTSB
SCHEMBL1587188 0.82 PPARA (0.54) PPARAPPARGCTSSCTSKCTSB
SCHEMBL3668697 0.81 PPARA (0.52) PPARAPPARGCTSSCTSKCTSB

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
US-5719141-A HYPOTENSIVE AGENTS NOVARTIS CORPORATION (US) 1998-02-17 US disclosed