SCHEMBL20885281

SCHEMBL20885281

CC(N)[C@H](NC(=O)OC(C)(C)C)C(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.54
▸ PPARA Q07869 3/20 0.51
▸ CTSS P25774 4/20 0.48
▸ ATM Q13315 1/20 0.48
▸ CTSL P07711 3/20 0.47
▸ MAPT P10636 1/20 0.47
▸ KLK5 Q9Y337 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ PPARG P37231 2/20 0.46
▸ CTSK P43235 2/20 0.46
▸ CTSB P07858 1/20 0.46
▸ LTA4H P09960 1/20 0.46
▸ NTSR1 P30989 1/20 0.46

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
SCHEMBL20885274 1.00 SYK (0.54) SYKPPARACTSSATMCTSL
SCHEMBL22579840 1.00 SYK (0.54) SYKPPARACTSSATMCTSL
SCHEMBL20854198 1.00 SYK (0.54) SYKPPARACTSSATMCTSL
SCHEMBL28432305 0.90 SYK (0.57) SYKCTSSATMCTSLCTSK
SCHEMBL30198452 0.90 SYK (0.57) SYKCTSSATMCTSLCTSK
SCHEMBL20869906 0.90 SYK (0.57) SYKCTSSATMCTSLCTSK
SCHEMBL20885241 0.90 SYK (0.57) SYKCTSSATMCTSLCTSK
SCHEMBL6388701 0.90 KLK5 (0.57) SYKPPARACTSSATMCTSL
SCHEMBL12873000 0.90 KLK5 (0.57) SYKPPARACTSSATMCTSL
SCHEMBL12214464 0.90 KLK5 (0.57) SYKPPARACTSSATMCTSL

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-2019070595-A1 AZTREONAM DERIVATIVES AND USES THEREOF ARIXA PHARMACEUTICALS, INC. (US) 2019-04-11 — — WO disclosed
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