SCHEMBL31064845

SCHEMBL31064845

CC(C)CC(NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C)C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 1/20 0.54
CTSL P07711 2/20 0.51
CTSS P25774 2/20 0.51
CTSK P43235 2/20 0.51
CTSB P07858 1/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
MAP1LC3B Q9GZQ8 1/20 0.49
MAP1LC3A Q9H492 1/20 0.49
EGFR P00533 2/20 0.49
CAPN1 P07384 2/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
FPR2 P25090 1/20 0.45
REN P00797 1/20 0.45
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL27613630 0.86 CTSS (0.48) AAK1CTSSCTSKKMT2AMEN1
SCHEMBL27613700 0.86 CTSS (0.48) AAK1CTSSCTSKKMT2AMEN1
SCHEMBL9490468 0.85 AAK1 (0.62) AAK1CTSLCTSSCTSKCTSB
SCHEMBL30134945 0.85 AAK1 (0.69) AAK1CTSLCTSSCTSKCTSB
SCHEMBL9609480 0.85 CTSK (0.59) AAK1CTSLCTSSCTSKCTSB
SCHEMBL9610763 0.85 CTSK (0.59) AAK1CTSLCTSSCTSKCTSB
SCHEMBL4423023 0.84 AAK1 (0.55) AAK1CTSLCTSSCTSKCTSB
SCHEMBL21643188 0.84 AAK1 (0.55) AAK1CTSLCTSSCTSKCTSB
SCHEMBL6767860 0.84 CTSS (0.44) CTSLCTSSCTSKCTSBKMT2A
SCHEMBL25008453 0.83 AAK1 (0.57) AAK1CTSLCTSSCTSKCTSB

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-4680291-A1 WOUND DRESSING University of Sunderland (GB) 2026-01-21 EP disclosed
WO-2024189382-A1 WOUND DRESSING UNIVERSITY OF SUNDERLAND (GB) 2024-09-19 WO disclosed