SCHEMBL30845997

SCHEMBL30845997

COc1ccc2c(c1)CN(C(=O)c1cc(C(=O)N3Cc4cccc(F)c4C3)ccc1O)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRAP1 Q12931 20/20 1.00
HSP90B1 P14625 11/20 0.77

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
SCHEMBL27138571 1.00 TRAP1 (1.00) TRAP1HSP90B1
SCHEMBL27142819 0.88 TRAP1 (1.00) TRAP1HSP90B1
SCHEMBL27153449 0.88 TRAP1 (1.00) TRAP1HSP90B1
SCHEMBL27153464 0.87 TRAP1 (1.00) TRAP1HSP90B1
SCHEMBL27153457 0.87 TRAP1 (1.00) TRAP1HSP90B1
SCHEMBL30845998 0.85 TRAP1 (1.00) TRAP1HSP90B1
SCHEMBL27153542 0.85 TRAP1 (1.00) TRAP1HSP90B1
SCHEMBL27143810 0.82 TRAP1 (1.00) TRAP1HSP90B1
SCHEMBL30845995 0.82 TRAP1 (1.00) TRAP1HSP90B1
SCHEMBL27153375 0.81 TRAP1 (0.86) TRAP1HSP90B1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4573087-A1 USE OF (ISOINDOLIN-2-YL)(4-HYDROXY-3-(ISOINDOLINE-2-CARBONYL)PHENYL)METHANONES IN THE TREATMENT OF TUMOR NECROSIS FACTOR RECEPTOR-ASSOCIATED PROTEIN 1 DYSFUNCTION University of Notre Dame du Lac (US) 2025-06-25 EP disclosed
WO-2024044553-A1 USE OF (ISOINDOLIN-2-YL)(4-HYDROXY-3-(ISOINDOLINE-2-CARBONYL)PHENYL)METHANONES IN THE TREATMENT OF TUMOR NECROSIS FACTOR RECEPTOR-ASSOCIATED PROTEIN 1 DYSFUNCTION UNIVERSITY OF NOTRE DAME DU LAC (US) 2024-02-29 WO disclosed