SCHEMBL29375200

SCHEMBL29375200

CC[C@H](C)[C@@H]1NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)CC)NC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB11 A5LHX3 1/20 0.46
PSMA7 O14818 1/20 0.46
PSMB1 P20618 1/20 0.46
PSMA1 P25786 1/20 0.46
PSMA2 P25787 1/20 0.46
PSMA3 P25788 1/20 0.46
PSMA4 P25789 1/20 0.46
PSMB8 P28062 1/20 0.46
PSMB9 P28065 1/20 0.46
PSMA5 P28066 1/20 0.46
PSMB4 P28070 1/20 0.46
PSMB6 P28072 1/20 0.46
PSMB5 P28074 1/20 0.46
PSMB10 P40306 1/20 0.46
PSMB3 P49720 1/20 0.46
PSMB2 P49721 1/20 0.46
PSMA6 P60900 1/20 0.46
PSMA8 Q8TAA3 1/20 0.46
PSMB7 Q99436 1/20 0.46
HDAC1 Q13547 2/20 0.43

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
SCHEMBL29885671 0.88 PSMB11 (0.38) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL31399270 0.85 KEAP1 (0.44) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL30819201 0.84 KDM4E (0.38) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL17867100 0.84 KDM4E (0.38) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL29375137 0.84 KDM4E (0.38) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL31197219 0.83 SOAT2 (0.53) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL31197218 0.83 SOAT2 (0.53) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL23754416 0.79 CTSD (0.40) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL31509493 0.79 CTSD (0.40) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL13250134 0.79 CTSD (0.40) PSMB11PSMA7PSMB1PSMA1PSMA2

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
US-11243958-B2 Implementing contract-based polymorphic and parallelizable SQL user-defined scalar and aggregate functions TERADATA US, INC. (US) 2022-02-08 US disclosed