SCHEMBL8364977

SCHEMBL8364977

CC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSS P25774 10/20 0.51
CTSK P43235 9/20 0.51
CTSB P07858 4/20 0.49
LCK P06239 1/20 0.49
ACE P12821 1/20 0.48
CTSL P07711 2/20 0.47
ITGB3 P05106 1/20 0.46
ITGA2B P08514 1/20 0.46
PPARG P37231 2/20 0.45
PPARD Q03181 2/20 0.45
PPARA Q07869 2/20 0.45

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
SCHEMBL4118607 0.91 REN (0.52) CTSSCTSKCTSBLCKACE
SCHEMBL4786137 0.90 ACE (0.60) CTSSCTSKCTSBACECTSL
SCHEMBL1172086 0.90 ACE (0.60) CTSSCTSKCTSBACECTSL
SCHEMBL30829409 0.90 ACE (0.60) CTSSCTSKCTSBACECTSL
SCHEMBL3013717 0.88 LCK (0.64) CTSSCTSKCTSBLCKACE
SCHEMBL3013721 0.88 LCK (0.64) CTSSCTSKCTSBLCKACE
SCHEMBL31525018 0.88 ACE (0.59) CTSSCTSKCTSBACEITGB3
SCHEMBL14576986 0.86 LCK (0.52) CTSSCTSKCTSBLCKACE
SCHEMBL10042359 0.86 CTSS (0.48) CTSSCTSKCTSBLCKACE
SCHEMBL4653261 0.86 CTSS (0.54) CTSSCTSKCTSBLCKACE

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-2003057722-A2 CYCLIC TETRAPEPTIDE COMPOUND AND USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-07-17 WO disclosed