SCHEMBL27971273

SCHEMBL27971273

O=C(NC(=O)c1c(O)cccc1CCO)NC1c2ccccc2-c2ccccc21

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PPIA P62937 20/20 0.74

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
SCHEMBL27971272 0.93 PPIA (0.65) PPIA
SCHEMBL27971369 0.86 PPIA (1.00) PPIA
SCHEMBL28813669 0.77 PPIA (0.68) PPIA
SCHEMBL27980327 0.77 PPIA (1.00) PPIA
SCHEMBL28813875 0.77 PPIA (1.00) PPIA
SCHEMBL27980358 0.77 PPIA (1.00) PPIA
SCHEMBL27971247 0.75 PPIA (0.73) PPIA
SCHEMBL28813863 0.74 PPIA (1.00) PPIA
SCHEMBL27971242 0.74 PPIA (0.70) PPIA
SCHEMBL27971245 0.73 PPIA (0.68) PPIA

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
CN-104058996-A Anti-hepatitis C virus compound, preparation method and application thereof UNIV TSINGHUA 2014-09-24 — — CN disclosed
Send feedback