SCHEMBL4734608

SCHEMBL4734608

Oc1cccc(Nc2nccc(-c3ccc(Cl)c(Cl)c3)n2)c1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 6/20 0.69
PIK3CA P42336 5/20 0.69
PIK3CB P42338 4/20 0.69
SYK P43405 1/20 0.58
PLK1 P53350 5/20 0.55
CAMK2D Q13557 3/20 0.55
CDK4 P11802 2/20 0.55
CDK2 P24941 2/20 0.55
ABL1 P00519 1/20 0.53
BCR P11274 1/20 0.53
PRKCA P17252 1/20 0.53
PRKCD Q05655 1/20 0.53
KDR P35968 1/20 0.52
PTK2 Q05397 1/20 0.52
AURKB Q96GD4 1/20 0.52
JAK2 O60674 2/20 0.50
MAPK8 P45983 1/20 0.50
GSK3B P49841 1/20 0.50
CAMKK2 Q96RR4 1/20 0.50

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
SCHEMBL4737537 0.87 SYK (0.67) PIK3CGSYKPLK1CAMK2DCDK4
SCHEMBL4905928 0.86 PLK1 (0.72) SYKPLK1CAMK2DCDK4CDK2
SCHEMBL4735987 0.86 PIK3CA (0.68) PIK3CGPIK3CAPIK3CBSYKPLK1
SCHEMBL2944088 0.82 ABL1 (0.64) PIK3CGPIK3CAPIK3CBSYKPLK1
SCHEMBL2945644 0.81 PLK1 (0.79) PIK3CGSYKPLK1CAMK2DCDK4
SCHEMBL27116530 0.80 PLK1 (0.68) PIK3CGSYKPLK1CAMK2DCDK4
SCHEMBL4738534 0.80 PIK3CA (0.78) PIK3CGPIK3CAPIK3CBPLK1CAMK2D
SCHEMBL4733859 0.79 PIK3CG (0.80) PIK3CGPIK3CAPIK3CBSYKPLK1
SCHEMBL27612399 0.79 PIK3CA (0.74) PIK3CGPIK3CAPIK3CBSYKPLK1
SCHEMBL4786174 0.79 PLK1 (0.57) PIK3CGSYKPLK1CAMK2DCDK4

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 14 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
WO-2008065155-A1 CDK INHIBITORS FOR TREATING PAIN INGENIUM PHARMACEUTICALS GMBH (DE) 2008-06-05 WO 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 PIK3CG 1548/4885PIK3CA 780/4885PIK3CB 1461/4885
US-20080153822-A1 Methods of treating pain OPRL1, ACHE, OPRK1 PIK3CG 4311/4885PIK3CA 4390/4885PIK3CB 4543/4885

“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.