SCHEMBL2104798

SCHEMBL2104798

Fc1cnc(Nc2ccc(Cl)c(Cl)c2)nc1NC1CCC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 2/20 0.60
KMT2A Q03164 1/20 0.52
SYK P43405 9/20 0.51
ULK1 O75385 1/20 0.50
STK17A Q9UEE5 2/20 0.49
STK17B O94768 1/20 0.49
EGFR P00533 2/20 0.47
BTK Q06187 2/20 0.47
CTSC P53634 1/20 0.46
BMX P51813 1/20 0.46
AURKA O14965 1/20 0.46

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
SCHEMBL2103262 0.87 BCL6 (0.80) BCL6SYKULK1STK17ASTK17B
SCHEMBL2101164 0.83 BCL6 (0.59) BCL6KMT2ASYKULK1EGFR
Hydrochloric Acid SCHEMBL27662179 0.83 SYK (0.61) BCL6SYKSTK17AEGFRBTK
SCHEMBL3495845 0.82 PRKCQ (0.56) BCL6SYKSTK17ASTK17BEGFR
SCHEMBL12952094 0.81 SYK (0.59) BCL6SYKSTK17AEGFRBTK
Hydrochloric Acid SCHEMBL27662239 0.80 SYK (0.58) BCL6SYKSTK17AEGFRBTK
SCHEMBL12952476 0.79 SYK (0.63) BCL6KMT2ASYKULK1STK17A
SCHEMBL29695636 0.79 AURKA (0.67) KMT2ASYKSTK17AEGFRBTK
SCHEMBL3494949 0.78 BCL6 (0.64) BCL6SYKSTK17AEGFRBTK
SCHEMBL29695663 0.78 BTK (0.65) KMT2ASYKSTK17AEGFRBTK

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