SCHEMBL23665677

SCHEMBL23665677

O=C(Cc1ccccn1)N[C@@H](Cc1coc2ccccc12)B(O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 18/20 1.00
PSMB8 P28062 6/20 0.80

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
SCHEMBL17653791 1.00 PSMB5 (1.00) PSMB5PSMB8
SCHEMBL23017753 0.89 PSMB5 (1.00) PSMB5PSMB8
SCHEMBL17653731 0.89 PSMB5 (1.00) PSMB5PSMB8
SCHEMBL23017774 0.89 PSMB5 (1.00) PSMB5PSMB8
SCHEMBL17653781 0.89 PSMB5 (1.00) PSMB5PSMB8
SCHEMBL23665754 0.86 PSMB5 (0.78) PSMB5PSMB8
SCHEMBL25141010 0.85 PSMB5 (0.73) PSMB5PSMB8
SCHEMBL17653633 0.84 PSMB5 (1.00) PSMB5PSMB8
SCHEMBL23017745 0.84 PSMB5 (1.00) PSMB5PSMB8
SCHEMBL23017720 0.83 PSMB5 (1.00) PSMB5PSMB8

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-2021143923-A1 BORONIC ACID DERIVATIVES 首药控股(北京)股份有限公司 2021-07-22 WO disclosed