SCHEMBL25829813

SCHEMBL25829813

CCCCCCN(C(=O)C[C@@H](C)CC)[C@H](C[C@@H](OC(C)=O)c1nc(C(=O)O)cs1)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 1/20 0.36

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
SCHEMBL22154624 0.90 PLA2G4A (0.40) PLA2G4A
SCHEMBL25828331 0.88
SCHEMBL23551975 0.85 PLA2G4A (0.31) PLA2G4A
SCHEMBL15033314 0.85 PLA2G4A (0.31) PLA2G4A
SCHEMBL17739739 0.84 ABCB1 (0.32)
SCHEMBL25827793 0.83 ABCB1 (0.38) PLA2G4A
SCHEMBL22154595 0.82 PLA2G4A (0.32) PLA2G4A
SCHEMBL25825751 0.82 ABCB1 (0.32)
SCHEMBL24140370 0.81 PLA2G4A (0.41) PLA2G4A
SCHEMBL24140512 0.81 EPHX2 (0.31) PLA2G4A

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-2023129518-A1 TUBULYSINS AND PROTEIN-TUBULYSIN CONJUGATES REGENERON PHARMACEUTICALS, INC. (US) 2023-07-06 WO disclosed