SCHEMBL2103244

SCHEMBL2103244

COc1cc(Nc2ncc(F)c(Nc3ccc(Cl)c(Cl)c3)n2)cc(OC)c1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SYK P43405 8/20 0.67
AURKA O14965 4/20 0.65
BCL6 P41182 7/20 0.58
NCOR2 Q9Y618 1/20 0.55
BRD4 O60885 1/20 0.54
EGFR P00533 1/20 0.53

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
SCHEMBL2102001 0.91 BCL6 (0.71) SYKAURKABCL6NCOR2
SCHEMBL2104215 0.89 SYK (0.60) SYKAURKABCL6NCOR2EGFR
SCHEMBL2104446 0.86 SYK (0.66) SYKAURKABCL6NCOR2EGFR
SCHEMBL655635 0.83 BCL6 (0.80) SYKAURKABCL6NCOR2EGFR
SCHEMBL2103777 0.83 SYK (0.63) SYKAURKABCL6BRD4EGFR
SCHEMBL2104221 0.82 BCL6 (0.63) SYKAURKABCL6NCOR2
SCHEMBL14607313 0.81 SYK (0.67) SYKAURKAEGFR
SCHEMBL657059 0.81 SYK (0.77) SYKAURKA
SCHEMBL2102179 0.81 BCL6 (0.72) SYKAURKABCL6NCOR2EGFR
SCHEMBL2101082 0.81 BCL6 (0.72) SYKAURKABCL6NCOR2EGFR

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2130541-A2 Methods of treating or preventing autoimmune diseases with 2,4-pyrimidinediamine compounds Rigel Pharmaceuticals, Inc. (US) 2009-12-09 EP claimed
US-8557806-B2 Methods of treating or preventing autoimmune diseases with 2,4-pyrimidinediamine compounds RIGEL PHARMACEUTICALS, INC. (US) 2013-10-15 US disclosed
US-8158621-B2 Methods of treating or preventing autoimmune diseases with 2,4-pyrimidinediamine compounds RIGEL PHARMACEUTICALS, INC. (US) 2012-04-17 US disclosed
US-7825116-B2 -(2-Aminopyrid-6-yl)-5-fluoro-N2-[3-(N-methylamino)carbonylmethyleneoxyphenyl]-2,4-pyrimidinediamine; signal transduction cascade inhibitor; Fc receptors for immunoglobulins IgE and IgG antagonist; autoimmune diseases, antiinflammatory agent; rheumatoid arthritis, multiple sclerosis RIGEL PHARMACEUTICALS, INC. (US) 2010-11-02 US disclosed
US-7812029-B1 such as N4-[(2,2-Dimethyl-4H-benzo[1,4]oxazin-3-one)-6-yl]-5-fluoro-N2-[3-(methylaminocarbonylmethyleneoxy)phenyl]-2,4-pyrimidinediamine; Glomerulonephritis; rheumatoid arthritis; systemic lupus erythematosis; multiple sclerosis RIGEL PHARMACEUTICALS, INC. (US) 2010-10-12 US disclosed
US-7517886-B2 Methods of treating or preventing autoimmune diseases with 2,4-pyrimidinediamine compounds RIGEL PHARMACEUTICALS, INC. (US) 2009-04-14 US disclosed
CN-1678321-A Methods of treating or preventing autoimmune diseases with 2, 4-pyrimidinediamine compounds RIGEL PHARMACEUTICALS INC (US) 2005-10-05 CN disclosed