SCHEMBL2944816

SCHEMBL2944816

FC(F)(F)c1ccc(Nc2nccc(-c3cccc(C(F)(F)F)c3)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.60
CLK2 P49760 1/20 0.60
DYRK1A Q13627 1/20 0.60
CLK4 Q9HAZ1 1/20 0.60
DYRK1B Q9Y463 1/20 0.60
PLK1 P53350 4/20 0.59
SYK P43405 1/20 0.58
AURKA O14965 3/20 0.56
MTOR P42345 1/20 0.56
SMG1 Q96Q15 1/20 0.56
GSK3B P49841 6/20 0.56
CDK2 P24941 2/20 0.55
KMO O15229 1/20 0.54
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
CDK5 Q00535 1/20 0.52
KMT2A Q03164 1/20 0.52
CDK5R1 Q15078 1/20 0.52
IKBKB O14920 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
SCHEMBL4738297 0.91 PLK1 (0.68) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL30554478 0.89 PLK1 (0.72) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL2946515 0.89 PLK1 (0.77) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL25337631 0.89 PLK1 (0.72) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL25979971 0.88 PLK1 (0.54) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL25339601 0.88 PLK1 (0.54) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL30554555 0.88 PLK1 (0.54) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL25337261 0.87 PLK1 (0.53) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL30554508 0.87 PLK1 (0.53) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL2955416 0.86 GSK3B (0.57) CLK1CLK2DYRK1ACLK4DYRK1B

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7759357-B2 Phenylpyrimidine amines as IgE inhibitors NOVARTIS AG (CH) 2010-07-20 US disclosed
US-20080279829-A1 Phenyl-(4-Phenyl-Pyrimidin-2-Yl)-Amines For Enhancing Immunotolerance WOISETSCHLAEGER MAXIMILIAN 2008-11-13 US disclosed
EP-1474146-B1 PHENYLPYRIMIDINE AMINES AS IGE INHIBITORS NOVARTIS AG (CH) 2008-08-27 EP disclosed
EP-1933839-A1 PHENYL-(4-PHENYL-PYRIMIDIN-2-YL)-AMINES FOR ENHANCING IMMUNOTOLERANCE Novartis AG (CH) 2008-06-25 EP disclosed
US-20070281956-A1 Phenylpyrimidine amines as IgE inhibitors NOVARTIS AG (CH) 2007-12-06 US disclosed
WO-2007039216-A1 PHENYL-(4-PHENYL-PYRIMIDIN-2-YL)-AMINES FOR ENHANCING IMMUNOTOLERANCE NOVARTIS AG (CH) 2007-04-12 WO disclosed
WO-2007039216-A1 PHENYL-(4-PHENYL-PYRIMIDIN-2-YL)-AMINES FOR ENHANCING IMMUNOTOLERANCE NOVARTIS AG (CH) 2007-04-12 WO disclosed
US-20050119255-A1 Phenylpyrimidine amines as ige inhibitors BULUSU MURTY (AT) 2005-06-02 US disclosed
EP-1474146-A1 PHENYLPYRIMIDINE AMINES AS IGE INHIBITORS Novartis AG (CH) 2004-11-10 EP disclosed
WO-2003063871-A1 PHENYLPYRIMIDINE AMINES AS IGE INHIBITORS NOVARTIS AG (CH) 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 (3 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-20080279829-A1 Phenyl-(4-Phenyl-Pyrimidin-2-Yl)-Amines For Enhancing Immunotolerance IFNG, IL2, LY96 CLK1 4156/4885CLK2 3465/4885DYRK1A 2808/4885
US-20070281956-A1 Phenylpyrimidine amines as IgE inhibitors FCER2, SELP, FCGR2A CLK1 3948/4885CLK2 3507/4885DYRK1A 2320/4885
US-20050119255-A1 Phenylpyrimidine amines as ige inhibitors FCER2, SELP, FCGR2A CLK1 3948/4885CLK2 3507/4885DYRK1A 2320/4885

“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.