SCHEMBL2956376

SCHEMBL2956376

FC(F)(F)c1cc(Nc2nccc(-c3cccc(Cl)c3)n2)ccc1Cl

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.68
GSK3B P49841 9/20 0.68
CDK4 P11802 4/20 0.68
CCND3 P30281 3/20 0.68
CAMK2D Q13557 5/20 0.60
CDK2 P24941 3/20 0.58
ABL1 P00519 1/20 0.58
BCR P11274 1/20 0.58
PRKCA P17252 1/20 0.58
PRKCD Q05655 1/20 0.58
BRAF P15056 1/20 0.56
MAPK14 Q16539 1/20 0.56
CCNA2 P20248 2/20 0.53
CCNA1 P78396 2/20 0.53
PIM1 P11309 2/20 0.52
MTOR P42345 1/20 0.52

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
SCHEMBL2955040 0.90 GSK3B (0.68) PLK1GSK3BCDK4CCND3CAMK2D
SCHEMBL30554522 0.87 PLK1 (0.65) PLK1GSK3BCDK4CCND3CAMK2D
SCHEMBL25980185 0.87 PLK1 (0.65) PLK1GSK3BCDK4CCND3CAMK2D
SCHEMBL2946515 0.85 PLK1 (0.77) PLK1GSK3BCDK4CCND3CAMK2D
SCHEMBL21074128 0.83 BRAF (0.65) GSK3BCDK4CCND3CDK2ABL1
SCHEMBL4732841 0.81 PLK1 (1.00) PLK1GSK3BCDK4CCND3CAMK2D
SCHEMBL19966865 0.81 BRAF (0.68) GSK3BCDK4CCND3CAMK2DABL1
SCHEMBL30335652 0.81 PLK1 (0.60) PLK1GSK3BCDK4CCND3CAMK2D
SCHEMBL25068552 0.81 CDK4 (1.00) PLK1GSK3BCDK4CCND3CAMK2D
SCHEMBL30847276 0.80 CDK4 (0.52) GSK3BCDK4CCND3CDK2BRAF

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 11 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
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 PLK1 1369/4885GSK3B 4583/4885CDK4 2063/4885
US-20070281956-A1 Phenylpyrimidine amines as IgE inhibitors FCER2, SELP, FCGR2A PLK1 1234/4885GSK3B 2749/4885CDK4 692/4885
US-20050119255-A1 Phenylpyrimidine amines as ige inhibitors FCER2, SELP, FCGR2A PLK1 1234/4885GSK3B 2749/4885CDK4 692/4885

“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.