SCHEMBL2598684

SCHEMBL2598684

O=C([AsH2])c1cncc(-c2cc(I)ncn2)c1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.44
KMO O15229 8/20 0.36
MKNK1 Q9BUB5 2/20 0.32
MKNK2 Q9HBH9 2/20 0.32

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
SCHEMBL1444762 0.85 MKNK1 (0.44) MIFKMOMKNK1MKNK2
SCHEMBL2598758 0.71 MIF (0.38) MIF
SCHEMBL1444763 0.69 MIF (0.65) MIFKMO
SCHEMBL14804510 0.69 MIF (0.42) MIFKMO
SCHEMBL1445810 0.68 MIF (0.57) MIFKMO
SCHEMBL1445299 0.67 MIF (0.56) MIFKMOMKNK1MKNK2
SCHEMBL20813389 0.64 MIF (0.68) MIFKMO
SCHEMBL14804511 0.63 MIF (0.40) MIF
SCHEMBL14818901 0.63 MIF (0.40) MIF
SCHEMBL17547132 0.63 MKNK1 (0.47) MKNK1MKNK2

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-2011146824-A1 METHODS AND COMPOSITIONS FOR MODULATING OCULAR DAMAGE UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2011-11-24 WO disclosed