SCHEMBL14729765

SCHEMBL14729765

O=C(O)[C@@H]1CC12CCN(c1ccc(Nc3nc(-c4ccccc4)nc4cn[nH]c(=O)c34)cn1)CC2

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SYK P43405 19/20 0.81
JAK2 O60674 12/20 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
SCHEMBL20529570 1.00 SYK (0.81) SYKJAK2
SCHEMBL14717914 1.00 SYK (0.81) SYKJAK2
SCHEMBL14717294 0.90 SYK (1.00) SYKJAK2
SCHEMBL30604793 0.87 SYK (0.69) SYKJAK2
SCHEMBL14717049 0.86 SYK (1.00) SYKJAK2
SCHEMBL29635081 0.86 SYK (1.00) SYKJAK2
SCHEMBL14729762 0.86 SYK (1.00) SYKJAK2
SCHEMBL29635121 0.85 SYK (1.00) SYKJAK2
SCHEMBL14716887 0.85 SYK (1.00) SYKJAK2
SCHEMBL20376755 0.85 SYK (0.67) SYKJAK2

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-2013028818-A1 PYRIMIDO- PYRIDAZINONE COMPOUNDS AND USE THEREOF ENDO PHARMACEUTICALS INC. (US) 2013-02-28 WO disclosed