SCHEMBL27601161

SCHEMBL27601161

Nc1nc(=O)[nH]cc1I.O=CCO

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PNP P00491 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
SCHEMBL18259564 0.76 MAPK1 (0.35)
Flucytosine SCHEMBL3510942 0.76 DPYD (0.31)
Pyrimidine SCHEMBL25286026 0.75 DPYD (0.33)
SCHEMBL2512344 0.69 SUMO1 (0.36) PNP
SCHEMBL7598067 0.69 PNP (0.35) PNP
SCHEMBL29512549 0.68 SUMO1 (0.36) PNP
SCHEMBL542389 0.67 PNP (0.37) PNP
SCHEMBL932306 0.67
SCHEMBL11153548 0.67
SCHEMBL16432349 0.67 SUMO1 (0.33) PNP

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-1491111-A Antiviral method of use 2004-04-21 CN disclosed