SCHEMBL2103271

SCHEMBL2103271

Cc1cccc(C)c1Nc1ncc(F)c(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SYK P43405 13/20 0.77
AURKA O14965 3/20 0.54
EGFR P00533 2/20 0.53
CDK1 P06493 1/20 0.53
KDR P35968 1/20 0.48

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
SCHEMBL656396 0.87 SYK (1.00) SYKAURKAEGFRCDK1KDR
SCHEMBL31294146 0.87 SYK (1.00) SYKAURKAEGFRCDK1KDR
SCHEMBL2100561 0.85 SYK (0.86) SYKAURKAEGFRCDK1
SCHEMBL655726 0.85 SYK (0.80) SYKAURKA
SCHEMBL2102099 0.80 SYK (0.84) SYKAURKAEGFRCDK1KDR
SCHEMBL2103381 0.80 SYK (0.58) SYKAURKAEGFRCDK1KDR
SCHEMBL2102518 0.80 SYK (0.79) SYKAURKAEGFRCDK1
SCHEMBL656606 0.79 SYK (0.71) SYKAURKAEGFR
SCHEMBL2103286 0.78 SYK (0.66) SYKAURKAEGFR
SCHEMBL654388 0.78 SYK (0.81) SYKAURKAEGFRCDK1KDR

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