SCHEMBL8056938

SCHEMBL8056938

CCC1CCCOB(O)C1NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
VHL P40337 7/20 0.33
ELOC Q15369 5/20 0.33
ELOB Q15370 5/20 0.33
ELANE P08246 1/20 0.32

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
SCHEMBL8046058 0.89 VHL (0.35) VHLELOCELOBELANE
SCHEMBL8063588 0.85
SCHEMBL8056936 0.83 ELANE (0.34) VHLELOCELOBELANE
SCHEMBL4569722 0.81 ELANE (0.34) ELANE
SCHEMBL4259352 0.81 ELANE (0.34) ELANE
SCHEMBL8275235 0.75 ATM (0.45) ELANE
SCHEMBL8274197 0.75 ATM (0.45) ELANE
SCHEMBL11947497 0.75 ATM (0.45) ELANE
SCHEMBL8272849 0.74 ELANE (0.36) ELANE
SCHEMBL8273040 0.74 ELANE (0.36) ELANE

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
WO-2009046098-A1 NOVEL CYCLIC BORONATE INHIBITORS OF HCV REPLICATION SMITHKLINE BEECHAM CORPORATION (US) 2009-04-09 WO disclosed