SCHEMBL7445931

SCHEMBL7445931

CCCNC(=O)C(=O)C(CC(F)(F)F)N(C=O)OC(C)(C)C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSK P43235 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
SCHEMBL7445940 1.00 CTSK (0.30) CTSK
SCHEMBL7444369 0.93 EPHX1 (0.32) CTSK
SCHEMBL7444363 0.93 EPHX1 (0.32) CTSK
SCHEMBL7442731 0.91 EPHX1 (0.39)
SCHEMBL7442741 0.91 EPHX1 (0.39)
SCHEMBL7427926 0.87 ALDH1A1 (0.32)
SCHEMBL7427918 0.87 ALDH1A1 (0.32)
SCHEMBL7433110 0.85
SCHEMBL7433115 0.85
SCHEMBL7434747 0.84 CTSK (0.39) CTSK

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
US-6187905-B1 PEPTIDE COMPOUND WHICH INHIBITS VIRAL PROTEINASES; VIRICIDES FOR HEPATITIS C, HEPATITIS G, AND HUMAN GB VIRUSES HOFFMANN-LA ROCHE INC. 2001-02-13 US disclosed