SCHEMBL2103286

SCHEMBL2103286

Cc1cccc(C)c1Nc1ncc(F)c(Nc2ccc3c(c2)OCCO3)n1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.66
EGFR P00533 2/20 0.62
STK17A Q9UEE5 1/20 0.55
AURKA O14965 1/20 0.54
BRD4 O60885 1/20 0.52
ULK1 O75385 1/20 0.51

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
SCHEMBL656467 0.87 SYK (0.79) SYKEGFRSTK17AAURKAULK1
SCHEMBL31294168 0.87 SYK (0.79) SYKEGFRSTK17AAURKAULK1
SCHEMBL2103519 0.86 SYK (0.71) SYKEGFRSTK17ABRD4ULK1
SCHEMBL655046 0.85 SYK (0.64) SYKEGFRSTK17AAURKABRD4
SCHEMBL656182 0.85 SYK (0.74) SYKEGFRAURKA
SCHEMBL656609 0.84 SYK (0.70) SYKEGFRSTK17AAURKA
SCHEMBL8999994 0.84 SYK (0.71) SYKEGFRSTK17ABRD4ULK1
SCHEMBL655465 0.83 SYK (0.73) SYKEGFRAURKAULK1
SCHEMBL655817 0.83 SYK (0.76) SYKEGFRSTK17AAURKAULK1
SCHEMBL10229037 0.83 SYK (0.72) SYKEGFRAURKAULK1

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