SCHEMBL7344914

SCHEMBL7344914

CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OCC1CCCCC1)C(O)c1c(-c2ccccc2)c1=O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
REN P00797 10/20 0.51
PSEN1 P49768 5/20 0.46
PSEN2 P49810 5/20 0.46
APH1B Q8WW43 5/20 0.46
NCSTN Q92542 5/20 0.46
APH1A Q96BI3 5/20 0.46
PSENEN Q9NZ42 5/20 0.46
CTSK P43235 4/20 0.43
CTSS P25774 1/20 0.42
CTSL P07711 1/20 0.42

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
SCHEMBL7344926 1.00 REN (0.51) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7344715 0.91 REN (0.49) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7344729 0.91 REN (0.49) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7334867 0.87 CTSK (0.47) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7334877 0.87 CTSK (0.47) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7370417 0.86 CTSK (0.45) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7343508 0.86 CTSK (0.45) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7370421 0.86 CTSK (0.45) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL9227916 0.86 CTSK (0.45) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7373061 0.86 REN (0.43) RENPSEN1PSEN2APH1BNCSTN

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