SCHEMBL23218022

SCHEMBL23218022

CC(C)(C)OC(=O)NC(CCC(=O)O)C(=O)NCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 6/20 0.63
CTSK P43235 6/20 0.63
CTSB P07858 2/20 0.59
CTSL P07711 1/20 0.59
ATM Q13315 1/20 0.52
PPARG P37231 1/20 0.52
PPARA Q07869 1/20 0.52
AKT1 P31749 1/20 0.52
REN P00797 1/20 0.52
ACE P12821 1/20 0.51
BACE1 P56817 3/20 0.51
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA3 P07451 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CACNA1C Q13936 1/20 0.50

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
SCHEMBL17614472 1.00 CTSS (0.63) CTSSCTSKCTSBCTSLATM
SCHEMBL23218021 1.00 CTSS (0.63) CTSSCTSKCTSBCTSLATM
SCHEMBL17277928 0.91 CTSK (0.60) CTSSCTSKCTSBCTSLATM
SCHEMBL8574599 0.90 CTSS (0.61) CTSSCTSKCTSBCTSLATM
SCHEMBL8574604 0.90 CTSS (0.61) CTSSCTSKCTSBCTSLATM
SCHEMBL18546494 0.89 CTSK (0.64) CTSSCTSKCTSBCTSLATM
SCHEMBL25884513 0.89 CTSK (0.64) CTSSCTSKCTSBCTSLATM
SCHEMBL18546605 0.89 CTSK (0.64) CTSSCTSKCTSBCTSLATM
SCHEMBL22236516 0.89 CTSK (0.68) CTSSCTSKCTSBCTSLATM
SCHEMBL24648945 0.89 CTSK (0.50) CTSSCTSKCTSBCTSLREN

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
WO-2022076905-A1 ALK5 INHIBITORS, CONJUGATES, AND USES THEREOF SILVERBACK THERAPEUTICS, INC. (US) 2022-04-14 WO disclosed
WO-2021072330-A1 GALNAC-TGFBR1 INHIBITOR CONJUGATES FOR THE TREATMENT OF LIVER DISEASES SILVERBACK THERAPEUTICS, INC. (US) 2021-04-15 WO disclosed