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SCHEMBL25712593

SCHEMBL25712593

CSCC[C@H](NC(=O)Cc1ccc(CNC(=O)[C@@H](NC(=O)[C@@H](N)CCSC)C(C)C)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCNC(C)=O)C(=O)O)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 11/20 0.45
▸ FNTB P49356 11/20 0.45
▸ BACE1 P56817 7/20 0.42
▸ BACE2 Q9Y5Z0 1/20 0.42
▸ PGGT1B P53609 5/20 0.42

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
SCHEMBL25712600 0.94 FNTA (0.42) FNTAFNTBBACE1BACE2PGGT1B
SCHEMBL30408279 0.84 FNTA (0.48) FNTAFNTBPGGT1B
SCHEMBL30407793 0.81 FNTA (0.50) FNTAFNTBBACE1BACE2PGGT1B
SCHEMBL25712442 0.81 FNTA (0.40) FNTAFNTBPGGT1B
SCHEMBL25712372 0.78 FNTA (0.44) FNTAFNTBPGGT1B
SCHEMBL20844324 0.77 FOLH1 (0.56) FNTAFNTBPGGT1B
SCHEMBL30495535 0.75 FNTA (0.51) FNTAFNTBBACE1PGGT1B
SCHEMBL34473997 0.74 FNTA (0.58) FNTAFNTBPGGT1B
SCHEMBL30051582 0.74 FNTA (0.58) FNTAFNTBPGGT1B
SCHEMBL31688029 0.73 FNTA (0.51) FNTAFNTBPGGT1B

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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