SCHEMBL10656655

SCHEMBL10656655

C[C@@H](NC(=O)[C@H](CCCCN)NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 7/20 0.50
▸ CTSS P25774 5/20 0.50
▸ ITGB3 P05106 8/20 0.46
▸ ITGA2B P08514 8/20 0.46
▸ HDAC4 P56524 3/20 0.45
▸ HDAC1 Q13547 3/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45
▸ MEN1 O00255 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CTSL P07711 1/20 0.43
▸ CTSB P07858 1/20 0.43

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
SCHEMBL31206686 0.88 ITGB3 (0.47) CTSKCTSSITGB3ITGA2BHDAC4
SCHEMBL8931425 0.87 CTSK (0.48) CTSKCTSSITGB3ITGA2BHDAC4
SCHEMBL32681199 0.87 CTSK (0.48) CTSKCTSSITGB3ITGA2BHDAC4
SCHEMBL28058553 0.87 CTSK (0.48) CTSKCTSSITGB3ITGA2BHDAC4
SCHEMBL8183191 0.87 MEN1 (0.57) CTSKCTSSITGB3ITGA2BHDAC4
SCHEMBL16909076 0.87 MEN1 (0.57) CTSKCTSSITGB3ITGA2BHDAC4
SCHEMBL918952 0.86 FOLH1 (0.53) CTSKCTSSITGB3ITGA2BHDAC4
SCHEMBL47004 0.86 FOLH1 (0.53) CTSKCTSSITGB3ITGA2BHDAC4
SCHEMBL376450 0.86 FOLH1 (0.53) CTSKCTSSITGB3ITGA2BHDAC4
SCHEMBL9980623 0.85 MEN1 (0.62) CTSKCTSSHDAC4HDAC1HDAC6

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
US-4742048-A Tetrapeptides and pentapeptides, their preparation and compositions containing them RHONE-POULENC INDUSTRIES (FR) 1988-05-03 — — US disclosed
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