SCHEMBL2102324

SCHEMBL2102324

COc1c(Cl)cc(Nc2ncc(F)c(Nc3ccc(OC(F)(F)F)c(Cl)c3)n2)cc1Cl

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 8/20 0.62
BCL6 P41182 9/20 0.60
NCOR2 Q9Y618 1/20 0.57
AURKA O14965 1/20 0.52
STK17B O94768 1/20 0.51
STK17A Q9UEE5 1/20 0.51
EPHB4 P54760 1/20 0.50
PTK2 Q05397 1/20 0.49

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
SCHEMBL2104446 0.91 SYK (0.66) SYKBCL6NCOR2AURKASTK17B
SCHEMBL2100643 0.91 BCL6 (0.72) SYKBCL6NCOR2AURKASTK17B
SCHEMBL2103260 0.88 SYK (0.64) SYKBCL6NCOR2AURKA
SCHEMBL2104215 0.86 SYK (0.60) SYKBCL6NCOR2AURKA
SCHEMBL655635 0.85 BCL6 (0.80) SYKBCL6NCOR2AURKASTK17B
SCHEMBL2101829 0.84 BCL6 (0.67) SYKBCL6NCOR2AURKASTK17B
SCHEMBL656862 0.83 SYK (0.68) SYKAURKA
SCHEMBL3999305 0.82 SYK (0.59) SYKBCL6NCOR2AURKASTK17B
SCHEMBL2102179 0.82 BCL6 (0.72) SYKBCL6NCOR2AURKASTK17B
SCHEMBL2101082 0.82 BCL6 (0.72) SYKBCL6NCOR2AURKASTK17B

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