SCHEMBL3378245

SCHEMBL3378245

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

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSK P43235 17/20 0.55
CTSS P25774 1/20 0.49

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
SCHEMBL3378597 0.95 CTSK (0.50) CTSKCTSS
SCHEMBL3375302 0.94 CTSK (0.49) CTSKCTSS
SCHEMBL3375850 0.94 CTSK (0.49) CTSKCTSS
SCHEMBL3378240 0.91 CTSK (0.48) CTSKCTSS
SCHEMBL3386138 0.91 CTSK (0.48) CTSKCTSS
SCHEMBL31127632 0.85 CTSK (0.54) CTSKCTSS
SCHEMBL17397503 0.85 CTSK (0.52) CTSKCTSS
SCHEMBL23515315 0.84 CTSK (0.56) CTSKCTSS
SCHEMBL18644348 0.84 CTSK (0.56) CTSKCTSS
SCHEMBL1722623 0.84 CTSK (0.50) CTSKCTSS

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-2012000608-A2 NOVEL BETA-AMINOALDEHYDE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR CHEMICAL USE AS REACTIVE INTERMEDIATES GLUESENKAMP KARL-HEINZ (DE) 2012-01-05 WO disclosed