SCHEMBL24521571

SCHEMBL24521571

CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSS P25774 11/20 0.66
CTSK P43235 10/20 0.66
CTSB P07858 4/20 0.54
CTSL P07711 2/20 0.54
PPARG P37231 1/20 0.50
PPARA Q07869 1/20 0.50
MTOR P42345 1/20 0.48
AKT1 P31749 1/20 0.48

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
SCHEMBL29052278 1.00 CTSS (0.66) CTSSCTSKCTSBCTSLPPARG
SCHEMBL24521573 0.89 CTSS (0.60) CTSSCTSKCTSBCTSLAKT1
SCHEMBL29052547 0.89 CTSS (0.60) CTSSCTSKCTSBCTSLAKT1
SCHEMBL29052292 0.88 CTSS (0.53) CTSSCTSKCTSBCTSLPPARG
SCHEMBL24521579 0.88 CTSS (0.53) CTSSCTSKCTSBCTSLPPARG
SCHEMBL3735628 0.87 CTSS (0.63) CTSSCTSKCTSBCTSLPPARG
SCHEMBL3735627 0.87 CTSS (0.63) CTSSCTSKCTSBCTSLPPARG
SCHEMBL3729929 0.86 CTSS (0.59) CTSSCTSKCTSBCTSLPPARG
SCHEMBL3729927 0.86 CTSS (0.59) CTSSCTSKCTSBCTSLPPARG
SCHEMBL3729928 0.86 CTSS (0.59) CTSSCTSKCTSBCTSLPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116583497-A N-benzyl-alpha-aminoamides as late promoting complex/loop (APC/C) inhibitors 科学研究高级委员会(CSIC) 2023-08-11 CN disclosed
WO-2022129397-A1 N-BENZYL-ALPHA-AMINOAMIDES AS ANAPHASE-PROMOTING COMPLEX/CYCLOSOME (APC/C) INHIBITORS CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (CSIC) (ES) 2022-06-23 WO disclosed
EP-4015501-A1 N-BENZYL-ALPHA-AMINOAMIDES AS ANAPHASE-PROMOTING COMPLEX/CYCLOSOME (APC/C) INHIBITORS Consejo Superior de Investigaciones Científicas (CSIC) (ES) 2022-06-22 EP disclosed