SCHEMBL7340230

SCHEMBL7340230

CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(O)c1c(-c2ccccc2)c1=O

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 12/20 0.56
PSMB1 P20618 1/20 0.53
CTSL P07711 6/20 0.52
CTSS P25774 4/20 0.52
CTSB P07858 1/20 0.52
REN P00797 1/20 0.51
CAPN1 P07384 2/20 0.51
CAPN2 P17655 1/20 0.51

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
SCHEMBL7347441 0.95 CTSK (0.51) CTSKPSMB1CTSLCTSSCTSB
SCHEMBL7347430 0.95 CTSK (0.51) CTSKPSMB1CTSLCTSSCTSB
SCHEMBL7338061 0.88 REN (0.47) CTSKPSMB1CTSLCTSSCTSB
SCHEMBL7338539 0.86 CTSK (0.59) CTSKPSMB1CTSLCTSSCTSB
SCHEMBL7338528 0.86 CTSK (0.59) CTSKPSMB1CTSLCTSSCTSB
SCHEMBL7335456 0.85 CTSK (0.51) CTSKPSMB1CTSLCTSSCTSB
SCHEMBL7335474 0.85 CTSK (0.51) CTSKPSMB1CTSLCTSSCTSB
SCHEMBL7335470 0.85 CTSK (0.51) CTSKPSMB1CTSLCTSSCTSB
SCHEMBL7344914 0.85 REN (0.51) CTSKCTSLCTSSREN
SCHEMBL7344926 0.85 REN (0.51) CTSKCTSLCTSSREN

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5416117-A Protease inhibitor MITSUBISHI KASEI CORPORATION (JP) 1995-05-16 US disclosed
EP-0520427-B1 Cyclopropenone derivatives MITSUBISHI CHEM IND (JP) 1994-12-14 EP disclosed
US-5328909-A Protease inhibitors MITSUBISHI KASEI CORPORATION (JP) 1994-07-12 US disclosed
EP-0520427-A1 Cyclopropenone derivatives Mitsubishi Chemical Corporation (JP) 1992-12-30 EP disclosed