SCHEMBL4786196

SCHEMBL4786196

CCCC(NC(=O)O)C(O)C(=O)NCC(=O)N[C@H](C(=O)N(C)C)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDF Q9HBH1 7/20 0.46

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
SCHEMBL3205858 1.00 PDF (0.46) PDF
SCHEMBL3215301 0.85 PDF (0.32) PDF
SCHEMBL4737245 0.85 PDF (0.32) PDF
Hydrochloric Acid SCHEMBL3222216 0.82 PDF (0.47) PDF
Hydrochloric Acid SCHEMBL3222231 0.82 PDF (0.47) PDF
SCHEMBL4784042 0.81 PSMB5 (0.36)
SCHEMBL4784938 0.81 PSMB11 (0.32)
SCHEMBL3210813 0.81 PSMB5 (0.36)
SCHEMBL3219837 0.77 SMN1; SMN2 (0.33)
SCHEMBL4785164 0.76 GPR88 (0.40)

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-2008074035-A1 HCV PROTEASE INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2008-06-19 WO disclosed