SCHEMBL14729787

SCHEMBL14729787

NCC1CCN(c2nc(Nc3ccc(N4CCC5(CC4)CC5C(=O)O)nc3)c3c(=O)[nH]ncc3n2)CC1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.83
JAK2 O60674 14/20 0.83

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
SCHEMBL14717244 0.91 SYK (1.00) SYKJAK2
SCHEMBL29635081 0.90 SYK (1.00) SYKJAK2
SCHEMBL14717049 0.90 SYK (1.00) SYKJAK2
SCHEMBL14729762 0.90 SYK (1.00) SYKJAK2
SCHEMBL14717914 0.83 SYK (0.81) SYKJAK2
SCHEMBL20529570 0.83 SYK (0.81) SYKJAK2
SCHEMBL14729765 0.83 SYK (0.81) SYKJAK2
SCHEMBL14729771 0.82 SYK (0.83) SYKJAK2
SCHEMBL14728768 0.82 SYK (0.85) SYKJAK2
SCHEMBL14717082 0.81 SYK (1.00) 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