SCHEMBL8604140

SCHEMBL8604140

CC(C)CC(C(=O)OC(C)(C)C)C(N)(C(=O)O)C(=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.46
PSMB5 P28074 1/20 0.42
CTSS P25774 3/20 0.42
CTSL P07711 2/20 0.42
POLB P06746 2/20 0.42
GAA P10253 1/20 0.42
SYK P43405 1/20 0.41
CTSB P07858 1/20 0.41

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
SCHEMBL27780857 0.84 LTA4H (0.44) PSMB5CTSSPOLBSYK
SCHEMBL9010277 0.83 CTSK (0.45) CTSKPSMB5CTSSCTSLPOLB
SCHEMBL6064499 0.83 ALDH1A1 (0.50) CTSK
SCHEMBL6064496 0.83 ALDH1A1 (0.50) CTSK
SCHEMBL4647195 0.80 ALDH1A1 (0.44) CTSKCTSSCTSLSYKCTSB
SCHEMBL27711459 0.79 ALDH1A1 (0.49) CTSK
SCHEMBL4424431 0.79 ALDH1A1 (0.49) CTSK
SCHEMBL27493616 0.79 LTA4H (0.44) POLBSYK
SCHEMBL27724812 0.78 SLC15A1 (0.44) CTSSSYK
SCHEMBL9327919 0.78 CTSK (0.45) CTSKCTSSCTSLPOLBGAA

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-1998007742-A1 SULFONAMIDES ZENECA LIMITED (GB) 1998-02-26 WO disclosed