SCHEMBL658197

SCHEMBL658197

Cn1ncc2cc(Nc3ncc(F)c(Nc4ccc5c(c4)NC(=O)C(C)(C)O5)n3)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 17/20 1.00
JAK1 P23458 3/20 0.53
JAK3 P52333 3/20 0.53
EGFR P00533 3/20 0.52
JAK2 O60674 2/20 0.52
LCK P06239 2/20 0.52
LYN P07948 2/20 0.52
FGFR4 P22455 2/20 0.52
BMPR1B O00238 1/20 0.49
CDC7 O00311 1/20 0.49
PIK3CD O00329 1/20 0.49
PLK4 O00444 1/20 0.49
STK25 O00506 1/20 0.49
CIT O14578 1/20 0.49
RIOK3 O14730 1/20 0.49
CHEK1 O14757 1/20 0.49
IKBKB O14920 1/20 0.49
AURKA O14965 1/20 0.49
GAK O14976 1/20 0.49
CHUK O15111 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
SCHEMBL2102266 1.00 SYK (1.00) SYKJAK1JAK3EGFRJAK2
SCHEMBL2105586 0.93 SYK (0.87) SYKJAK1JAK3EGFRJAK2
SCHEMBL2100833 0.93 SYK (0.87) SYKJAK1JAK3EGFRJAK2
SCHEMBL2103401 0.87 SYK (0.77) SYKJAK1JAK3EGFRJAK2
SCHEMBL2101555 0.85 SYK (0.74) SYKJAK1JAK3EGFRJAK2
SCHEMBL12100695 0.85 SYK (0.74) SYKJAK1JAK3EGFRJAK2
SCHEMBL2102999 0.85 SYK (0.74) SYKJAK1JAK3EGFRJAK2
SCHEMBL658283 0.85 SYK (0.73) SYKJAK1JAK3EGFRJAK2
SCHEMBL2105664 0.85 SYK (0.73) SYKJAK1JAK3EGFRJAK2
SCHEMBL2785795 0.85 SYK (0.73) SYKJAK1JAK3EGFRJAK2

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 91 patents — showing the first 20. 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-20080039622-A1 Inhibiting the immunoglobulin (Ig) IgE and/or IgG receptor using R940343, N4-[(2,2-Difluoro-4H-benzo[1,4]oxazin-3-one)-6-yl]-5-fluoro-N2-[3-(methylaminocarbonylmethyleneoxy)phenyl]-2,4-pyrimidinediamine; treating allergic and inflammatory diseases; syk kinase inhibitors RIGEL PHARMACEUTICALS, INC. 2008-02-14 US claimed
US-20080027034-A1 Ciclesonide and Syk Inhibitor Combination and Method of Use Thereof NYCOMED GMBH (DE) 2008-01-31 US claimed
EP-1796679-A1 CICLESONIDE AND SYK INHIBITOR COMBINATION AND METHODS OF USE THEREOF Altana Pharma AG (DE) 2007-06-20 EP claimed
EP-1791538-A1 ROFLUMILAST AND SYK INHIBITOR COMBINATION AND METHODS OF USE THEREOF Altana Pharma AG (DE) 2007-06-06 EP claimed
WO-2006027378-A1 ROFLUMILAST AND SYK INHIBITOR COMBINATION AND METHODS OF USE THEREOF ALTANA PHARMA AG (DE) 2006-03-16 WO claimed
US-20060058292-A1 N4-[2,2-difluoro-4H-benzo[1,4]oxazin-3-one)-6-yl]-5-fluoro-N2-[3-(methylaminocarbonylmethyleneoxy)phenyl]-2,4-pyrimidinediamine; inhibit the immunoglobulins IgE or IgG receptor signaling cascades in mast, basophil cells; antiallergen, antiinflammatory agent; asthma, osteoarthritis MIDCAP FINANCIAL TRUST 2006-03-16 US claimed
WO-2006027377-A1 CICLESONIDE AND SYK INHIBITOR COMBINATION AND METHODS OF USE THEREOF ALTANA PHARMA AG (DE) 2006-03-16 WO claimed
US-20240158756-A1 FEEDER-BASED AND FEEDER-FREE STEM CELL CULTURE SYSTEMS FOR STRATIFIED EPITHELIAL STEM CELLS, AND USES RELATED THERETO UNIVERSITY OF HOUSTON SYSTEM (US) 2024-05-16 US disclosed
US-11007193-B2 2,4-pyrimidinediamine compounds and their uses RIGEL PHARMACEUTICALS, INC. (US) 2021-05-18 US disclosed
WO-2021072238-A1 FEEDER-BASED AND FEEDER-FREE STEM CELL CULTURE SYSTEMS FOR STRATIFIED EPITHELIAL STEM CELLS, AND USES RELATED THERETO UNIVERSITY OF HOUSTON SYSTEM (US) 2021-04-15 WO disclosed
US-10828301-B2 2,4-pyrimidinediamine compounds and their uses Rigel Pharmceuticals, Inc. (US) 2020-11-10 US disclosed
US-10709703-B2 2,4-pyrimidinediamine compounds and their uses RIGEL PHARMACEUTICALS, INC. (US) 2020-07-14 US disclosed
US-10682350-B2 2,4-pyrimidinediamine compounds and their uses RIGEL PHARMACEUTICALS, INC. (US) 2020-06-16 US disclosed
EP-1471915-A4 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS INC (US) 2006-02-15 EP disclosed
US-20050209230-A1 2-leaving group-4-(substituted amino)-5-fluoropyrimidines such as 2-chloro-N4-(2-hydroxyphenyl)-5-fluoro-4-pyrimidineamine; chemical intermediates to compounds that inhibit the immunoglobulin (Ig) IgE and/or IgG receptor signaling cascades MIDCAP FINANCIAL TRUST 2005-09-22 US disclosed
US-20050038243-A1 Prevent immunoglobulin receptors signaling cascading; prevention diseases; drugs; antiinflammatory agents MIDCAP FINANCIAL TRUST 2005-02-17 US disclosed
EP-1471915-A2 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES Rigel Pharmaceuticals, Inc. (US) 2004-11-03 EP disclosed
US-20040029902-A1 Antiinflamamtory agents MIDCAP FINANCIAL TRUST 2004-02-12 US disclosed
WO-2003063794-A2 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS, INC. (US) 2003-08-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080027034-A1 Ciclesonide and Syk Inhibitor Combination and Method of Use Thereof SYK, ZAP70, BTK SYK 1/4885JAK1 27/4885JAK3 56/4885
US-20060058292-A1 N4-[2,2-difluoro-4H-benzo[1,4]oxazin-3-one)-6-yl]-5-fluoro-N2-[3-(methylaminocarbonylmethyleneoxy)phenyl]-2,4-pyrimidinediamine; inhibit the immunoglobulins IgE or IgG receptor signaling cascades in mast, basophil cells; antiallergen, antiinflammatory agent; asthma, osteoarthritis FCER2, FCGR1A, HRH4 SYK 36/4885JAK1 729/4885JAK3 843/4885
US-20040029902-A1 Antiinflamamtory agents FCER2, FCGR1A, HNMT SYK 251/4885JAK1 495/4885JAK3 675/4885
US-20080039622-A1 Inhibiting the immunoglobulin (Ig) IgE and/or IgG receptor using R940343, N4-[(2,2-Difluoro-4H-benzo[1,4]oxazin-3-one)-6-yl]-5-fluoro-N2-[3-(methylaminocarbonylmethyleneoxy)phenyl]-2,4-pyrimidinediamine; treating allergic and inflammatory diseases; syk kinase inhibitors FCER2, FCGR1A, FCGR2A SYK 4/4885JAK1 224/4885JAK3 200/4885
US-10682350-B2 2,4-pyrimidinediamine compounds and their uses FCER2, FCGR1A, FCGR2A SYK 54/4885JAK1 512/4885JAK3 546/4885
US-10709703-B2 2,4-pyrimidinediamine compounds and their uses FCER2, FCGR1A, FCGR2A SYK 54/4885JAK1 512/4885JAK3 546/4885
US-20050209230-A1 2-leaving group-4-(substituted amino)-5-fluoropyrimidines such as 2-chloro-N4-(2-hydroxyphenyl)-5-fluoro-4-pyrimidineamine; chemical intermediates to compounds that inhibit the immunoglobulin (Ig) IgE and/or IgG receptor signaling cascades FCER2, FCGR1A, FCGR2A SYK 42/4885JAK1 608/4885JAK3 618/4885
US-20050038243-A1 Prevent immunoglobulin receptors signaling cascading; prevention diseases; drugs; antiinflammatory agents FCER2, FCGR1A, FCGR2A SYK 83/4885JAK1 290/4885JAK3 312/4885
US-11007193-B2 2,4-pyrimidinediamine compounds and their uses FCER2, FCGR1A, FCGR2A SYK 54/4885JAK1 512/4885JAK3 546/4885
US-10828301-B2 2,4-pyrimidinediamine compounds and their uses FCER2, FCGR1A, FCGR2A SYK 54/4885JAK1 512/4885JAK3 546/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.