SCHEMBL7797009

SCHEMBL7797009

CCCCCN(C(=O)CCC(C)CNC(=O)OC(C)(C)C)C(=O)COCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.45
CTSK P43235 5/20 0.41
CTSS P25774 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PPARA Q07869 1/20 0.39

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
SCHEMBL7139233 0.91 CTSK (0.41) CTSK
SCHEMBL7132057 0.82 HDAC3 (0.37)
SCHEMBL7132836 0.81 SIRT2 (0.44) CTSS
SCHEMBL7799740 0.76 SYK (0.47) SYKCTSKCTSSPPARA
SCHEMBL7797006 0.76 L3MBTL1 (0.45) CTSKL3MBTL1
SCHEMBL7139316 0.76 NAMPT (0.40) CTSKL3MBTL1
SCHEMBL7139673 0.73 CTSK (0.35) CTSK
SCHEMBL18085404 0.70 SYK (0.60) SYKL3MBTL1
SCHEMBL24365709 0.69 SYK (0.49) SYKCTSKCTSSPPARA
SCHEMBL2736627 0.69 ATM (0.56) SYKCTSKCTSS

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-1159260-A1 NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2001-12-05 EP disclosed
WO-2000055124-A2 NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2000-09-21 WO disclosed