SCHEMBL7754157

SCHEMBL7754157

COC[C@H](NC(=O)OC(C)(C)C)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.53
CTSS P25774 3/20 0.53
TAS1R3 Q7RTX0 1/20 0.50
TAS1R1 Q7RTX1 1/20 0.50
MAPT P10636 1/20 0.50
MMP2 P08253 6/20 0.47
MMP3 P08254 4/20 0.47
PPARA Q07869 2/20 0.47
ATM Q13315 1/20 0.47
TACR3 P29371 1/20 0.46
PPARG P37231 1/20 0.45
CTSL P07711 1/20 0.45
CTSB P07858 1/20 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
SCHEMBL19312076 1.00 CTSK (0.53) CTSKCTSSTAS1R3TAS1R1MAPT
SCHEMBL13184597 1.00 CTSK (0.53) CTSKCTSSTAS1R3TAS1R1MAPT
SCHEMBL90359 0.89 CTSK (0.51) CTSKCTSSMAPTPPARAATM
SCHEMBL89597 0.89 CTSK (0.51) CTSKCTSSMAPTPPARAATM
SCHEMBL19349000 0.86 CTSK (0.49) CTSKCTSSMAPTPPARAATM
SCHEMBL19348998 0.86 CTSK (0.49) CTSKCTSSMAPTPPARAATM
SCHEMBL17846052 0.86 CTSK (0.51) CTSKCTSSMAPTPPARAATM
SCHEMBL17724470 0.86 CTSK (0.51) CTSKCTSSMAPTPPARAATM
SCHEMBL22502330 0.86 CTSK (0.51) CTSKCTSSMAPTPPARAATM
SCHEMBL19305440 0.86 CTSK (0.51) CTSKCTSSMAPTPPARAATM

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024010810-A2 FC CONJUGATES INCLUDING AN INHIBITOR OF CD73 AND USES THEREOF CIDARA THERAPEUTICS, INC. (US) 2024-01-11 WO disclosed
EP-0691346-B1 Novel aspartyldipeptide derivatives and sweetener AJINOMOTO KK (JP) 2001-03-14 EP disclosed
US-5723165-A ARTIFICIAL SWEETENERS AJINOMOTO CO., INC. (JP) 1998-03-03 US disclosed
EP-0691346-A1 Novel aspartyldipeptide derivatives and sweetener Ajinomoto Co., Inc. (JP) 1996-01-10 EP disclosed