SCHEMBL30408032

SCHEMBL30408032

CSCC[C@H](NCc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN(C)C)C(=O)O)C(C)C

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 4/20 0.51
▸ FNTB P49356 4/20 0.51
▸ LTA4H P09960 1/20 0.46
▸ BACE1 P56817 9/20 0.45
▸ BACE2 Q9Y5Z0 1/20 0.45
▸ PGGT1B P53609 1/20 0.45
▸ ANPEP P15144 1/20 0.44

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
SCHEMBL30401382 0.89 FNTA (0.54) FNTAFNTBLTA4HBACE1BACE2
SCHEMBL30407793 0.86 FNTA (0.50) FNTAFNTBBACE1BACE2PGGT1B
SCHEMBL30402768 0.84 FNTA (0.56) FNTAFNTBLTA4HBACE1PGGT1B
SCHEMBL30401967 0.83 TLR2 (0.52) FNTAFNTBLTA4HBACE1PGGT1B
SCHEMBL30408473 0.80 FNTA (0.48) FNTAFNTBPGGT1B
SCHEMBL8843364 0.79 TLR2 (0.50) —
SCHEMBL30149850 0.78 ALDH1A1 (0.50) FNTAFNTBBACE1BACE2ANPEP
SCHEMBL8843370 0.78 TLR2 (0.49) —
SCHEMBL25712600 0.76 FNTA (0.42) FNTAFNTBBACE1BACE2PGGT1B
SCHEMBL30051569 0.76 FNTA (0.71) FNTAFNTBLTA4HPGGT1B

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-2023104794-A1 LINKER TECHNOLOGY FOR REDUCED RENAL RETENTION PAUL SCHERRER INSTITUT (CH) 2023-06-15 — — WO disclosed
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