SCHEMBL24344002

SCHEMBL24344002

CNc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRN P28799 3/20 0.51
SORT1 Q99523 3/20 0.51
BCL2L1 Q07817 1/20 0.51
FNTA P49354 1/20 0.50
FNTB P49356 1/20 0.50
PGGT1B P53609 1/20 0.50
PYGL P06737 1/20 0.50
MME P08473 1/20 0.49
CLPP Q16740 2/20 0.48
CA2 P00918 2/20 0.48
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
CTSS P25774 1/20 0.48
CTSK P43235 1/20 0.48
CA1 P00915 1/20 0.48

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
SCHEMBL300104 0.85 KDM4E (0.46) MMECA2CA1
SCHEMBL30497600 0.84 GRN (0.54) GRNSORT1BCL2L1FNTAFNTB
SCHEMBL9829479 0.82 KDM4E (0.59) GRNSORT1BCL2L1FNTAFNTB
SCHEMBL9829475 0.82 KDM4E (0.59) GRNSORT1BCL2L1FNTAFNTB
SCHEMBL27565835 0.82 NAALAD2 (0.51) PYGLCA2CA1
SCHEMBL6065018 0.82 NAALAD2 (0.51) PYGLCA2CA1
SCHEMBL838494 0.81 GRN (0.52) GRNSORT1BCL2L1FNTAFNTB
SCHEMBL23638345 0.81 KDM4E (0.60) GRNSORT1FNTAFNTBPGGT1B
SCHEMBL2669218 0.81 KDM4E (0.60) GRNSORT1FNTAFNTBPGGT1B
SCHEMBL6244616 0.79 CASP1 (0.57) GRNSORT1BCL2L1FNTAFNTB

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-2022072560-A1 POLYPEPTIDE TERMINAL BINDERS AND USES THEREOF Encodia, Inc. (US) 2022-04-07 WO disclosed