SCHEMBL9819706

SCHEMBL9819706

CC(C)(C)OC(=O)N[C@H](CC1CCCCC1)[C@H](O[Si](C)(C)C(C)(C)C)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.46
CTSK P43235 2/20 0.46
REN P00797 11/20 0.38
AAK1 Q2M2I8 1/20 0.38
CTSD P07339 1/20 0.37
CTSE P14091 1/20 0.37
CYP3A4 P08684 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
GAA P10253 1/20 0.35
EPHX1 P07099 1/20 0.34

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
SCHEMBL10777312 0.87 CTSS (0.46) CTSSCTSKRENAAK1CTSD
SCHEMBL7274874 0.87 CTSS (0.46) CTSSCTSKRENAAK1CTSD
SCHEMBL7273164 0.83 CTSK (0.53) CTSSCTSKRENAAK1CTSD
SCHEMBL7272354 0.82 CTSS (0.46) CTSSCTSKRENAAK1CTSD
SCHEMBL10407971 0.82 CTSS (0.46) CTSSCTSKRENAAK1CTSD
SCHEMBL7305026 0.82 CTSS (0.46) CTSSCTSKRENAAK1CTSD
SCHEMBL10448350 0.82 CTSS (0.46) CTSSCTSKRENAAK1CTSD
SCHEMBL8278836 0.81 CTSK (0.46) CTSSCTSKRENAAK1CTSD
SCHEMBL10777836 0.81 CTSS (0.44) CTSSCTSKRENAAK1CTSD
SCHEMBL10607579 0.80 CTSS (0.47) CTSSCTSKRENAAK1CTSD

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-5034376-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1991-07-23 US disclosed
US-4935405-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1990-06-19 US disclosed
US-4814342-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1989-03-21 US disclosed
EP-0266950-A2 Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1988-05-11 EP disclosed