SCHEMBL8291315

SCHEMBL8291315

CCNC(=O)C(=O)[C@@H]1CCCCCCCC[C@H](N)C(=O)N2C[C@H]3[C@@H]([C@H]2C(=O)N1)C3(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 1/20 0.30
▸ LNPEP Q9UIQ6 1/20 0.30

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
SCHEMBL8290334 1.00 ANPEP (0.30) ANPEPLNPEP
SCHEMBL12608390 0.91 — —
SCHEMBL8290607 0.91 — —
SCHEMBL12608386 0.89 — —
SCHEMBL8290345 0.89 — —
SCHEMBL8291430 0.89 — —
SCHEMBL12607111 0.88 — —
SCHEMBL12855972 0.87 GAA (0.31) —
SCHEMBL8047549 0.87 GAA (0.31) —
SCHEMBL8046504 0.86 — —

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-2005030796-A1 MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS NS3 SERINE PROTEASE SCHERING CORPORATION (US) 2005-04-07 — — WO disclosed
Send feedback