SCHEMBL25533140

SCHEMBL25533140

CCCC(NC(=O)OC(C)(C)C)C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSK P43235 15/20 0.51
CTSS P25774 4/20 0.51
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CYP2D6 P10635 1/20 0.45

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
SCHEMBL28668065 0.87 CTSK (0.50) CTSKCTSSCA1CA2CA7
SCHEMBL28668062 0.87 CTSK (0.50) CTSKCTSSCA1CA2CA7
SCHEMBL25985137 0.87 CTSK (0.50) CTSKCTSSCA1CA2CA7
SCHEMBL14533725 0.86 CTSK (0.49) CTSKCTSSCA1CA2CA7
SCHEMBL15959879 0.85 CA1 (0.50) CTSKCTSSCA1CA2CA7
SCHEMBL26035614 0.85 CA1 (0.50) CTSKCTSSCA1CA2CA7
SCHEMBL24427425 0.85 CA1 (0.53) CTSKCTSSCA1CA2CA7
SCHEMBL13605079 0.85 CA1 (0.53) CTSKCTSSCA1CA2CA7
SCHEMBL2681437 0.84 CTSK (0.43) CTSKCTSSCA1CA2CA7
SCHEMBL2681435 0.84 CTSK (0.43) CTSKCTSSCA1CA2CA7

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
EP-4180431-A1 CHEMICAL COMPOUNDS GlaxoSmithKline Intellectual Property Development Limited (GB) 2023-05-17 EP disclosed