SCHEMBL7337136

SCHEMBL7337136

CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)C1C(=O)C1c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSL P07711 10/20 0.52
CTSB P07858 4/20 0.52
CTSK P43235 4/20 0.52
CTSS P25774 2/20 0.52
TACR1 P25103 2/20 0.50

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
SCHEMBL7339599 0.89 CYP1A2 (0.48) CTSLCTSBCTSKCTSS
SCHEMBL7343203 0.89 CYP1A2 (0.48) CTSLCTSBCTSKCTSS
SCHEMBL7337274 0.79 PSMB1 (0.49) CTSLCTSBCTSKCTSS
SCHEMBL8399106 0.77 KDM1A (0.34)
SCHEMBL7337127 0.77 CTSL (0.53) CTSLCTSBCTSKCTSSTACR1
SCHEMBL7337140 0.77 CTSL (0.53) CTSLCTSBCTSKCTSSTACR1
SCHEMBL10802556 0.76 CTSL (0.70) CTSLCTSBCTSKCTSSTACR1
SCHEMBL19807564 0.76 TACR1 (0.72) CTSLCTSBCTSKCTSSTACR1
SCHEMBL7275434 0.74 ECE1 (0.65) CTSLCTSBCTSKCTSSTACR1
SCHEMBL9088735 0.74 CAPN1 (0.72) CTSLCTSBCTSKCTSSTACR1

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