SCHEMBL4732841

SCHEMBL4732841

Clc1ccc(Nc2nccc(-c3cccc(Cl)c3)n2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 4/20 1.00
CAMK2D Q13557 6/20 0.68
ABL1 P00519 1/20 0.66
BCR P11274 1/20 0.66
PRKCA P17252 1/20 0.66
PRKCD Q05655 1/20 0.66
PIK3CA P42336 2/20 0.64
PIK3CB P42338 2/20 0.64
PIK3CG P48736 2/20 0.64
CLK1 P49759 1/20 0.62
DYRK1A Q13627 1/20 0.62
CLK4 Q9HAZ1 1/20 0.62
DYRK1B Q9Y463 1/20 0.62
IKBKB O14920 2/20 0.57
SMG1 Q96Q15 1/20 0.57
CSNK2A1 P68400 1/20 0.56
CDK4 P11802 1/20 0.55
CCND3 P30281 1/20 0.55
GSK3B P49841 1/20 0.55
MEN1 O00255 1/20 0.55

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
SCHEMBL14651462 0.91 PLK1 (0.84) PLK1CAMK2DABL1BCRPRKCA
SCHEMBL4735460 0.91 PLK1 (0.82) PLK1CAMK2DABL1BCRPRKCA
SCHEMBL2946515 0.87 PLK1 (0.77) PLK1CAMK2DABL1BCRPRKCA
SCHEMBL3518914 0.85 IKBKB (0.74) PLK1CAMK2DABL1BCRPRKCA
SCHEMBL12274499 0.84 PLK1 (0.73) PLK1CAMK2DABL1BCRPRKCA
SCHEMBL4905928 0.84 PLK1 (0.72) PLK1CAMK2DABL1BCRPRKCA
SCHEMBL12275494 0.82 PLK1 (0.70) PLK1CAMK2DABL1BCRPRKCA
SCHEMBL12274500 0.82 CAMK2D (0.81) PLK1CAMK2DSMG1
SCHEMBL2956376 0.81 PLK1 (0.68) PLK1CAMK2DABL1BCRPRKCA
SCHEMBL12801709 0.81 CAMK2D (1.00) PLK1CAMK2DABL1BCRPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080153822-A1 Methods of treating pain INGENIUM PHARMACEUTICALS GMBH (DE) 2008-06-26 US claimed
WO-2008065155-A1 CDK INHIBITORS FOR TREATING PAIN INGENIUM PHARMACEUTICALS GMBH (DE) 2008-06-05 WO claimed
US-20070021419-A1 2-Aminophenyl-4-phenylpyrimidines as kinase inhibitors CYCLACEL LIMITED (GB) 2007-01-25 US claimed
JP-2007500179-A 2007-01-11 JP claimed
EP-1648875-A1 2-AMINOPHENYL-4-PHENYLPYRIMIDINES AS KINASE INHIBITORS Cyclacel Limited (GB) 2006-04-26 EP claimed
WO-2005012262-A1 2-AMINOPHENYL-4-PHENYLPYRIMIDINES AS KINASE INHIBITORS CYCLACEL LIMITED (GB) 2005-02-10 WO claimed
US-20080153822-A1 Methods of treating pain INGENIUM PHARMACEUTICALS GMBH (DE) 2008-06-26 US disclosed
US-20070021419-A1 2-Aminophenyl-4-phenylpyrimidines as kinase inhibitors CYCLACEL LIMITED (GB) 2007-01-25 US disclosed
US-20070021419-A1 2-Aminophenyl-4-phenylpyrimidines as kinase inhibitors CYCLACEL LIMITED (GB) 2007-01-25 US disclosed
US-20070021419-A1 2-Aminophenyl-4-phenylpyrimidines as kinase inhibitors CYCLACEL LIMITED (GB) 2007-01-25 US disclosed
EP-1648875-A1 2-AMINOPHENYL-4-PHENYLPYRIMIDINES AS KINASE INHIBITORS Cyclacel Limited (GB) 2006-04-26 EP disclosed
WO-2005012262-A1 2-AMINOPHENYL-4-PHENYLPYRIMIDINES AS KINASE INHIBITORS CYCLACEL LIMITED (GB) 2005-02-10 WO disclosed
WO-2005012262-A1 2-AMINOPHENYL-4-PHENYLPYRIMIDINES AS KINASE INHIBITORS CYCLACEL LIMITED (GB) 2005-02-10 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 (2 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-20070021419-A1 2-Aminophenyl-4-phenylpyrimidines as kinase inhibitors GRK3, NCOR1, GRM3 PLK1 1603/4885CAMK2D 1264/4885ABL1 684/4885
US-20080153822-A1 Methods of treating pain OPRL1, ACHE, OPRK1 PLK1 3544/4885CAMK2D 1498/4885ABL1 1154/4885

“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.