SCHEMBL4735284

SCHEMBL4735284

COc1cccc(-c2ccnc(Nc3ccc(O)cc3)n2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 4/20 0.70
▸ CDK5 Q00535 2/20 0.67
▸ MEN1 O00255 1/20 0.67
▸ NPC1 O15118 1/20 0.67
▸ RAB9A P51151 1/20 0.67
▸ KMT2A Q03164 1/20 0.67
▸ CDK5R1 Q15078 1/20 0.67
▸ PIK3CG P48736 5/20 0.65
▸ PIK3CA P42336 4/20 0.65
▸ PIK3CB P42338 4/20 0.65
▸ DYRK1A Q13627 2/20 0.56
▸ CLK4 Q9HAZ1 2/20 0.56
▸ DYRK1B Q9Y463 1/20 0.56
▸ CCNA2 P20248 1/20 0.56
▸ CDK2 P24941 1/20 0.56
▸ CCNA1 P78396 1/20 0.56
▸ MKNK1 Q9BUB5 1/20 0.55
▸ VCP P55072 1/20 0.55
▸ BRD4 O60885 1/20 0.55
▸ CDK9 P50750 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
SCHEMBL4785619 0.89 PIK3CG (0.70) PLK1CDK5MEN1NPC1RAB9A
SCHEMBL27116705 0.89 PIK3CG (0.73) PLK1CDK5MEN1NPC1RAB9A
SCHEMBL27116598 0.87 PIK3CG (0.83) CDK5MEN1NPC1RAB9AKMT2A
SCHEMBL4736128 0.85 PIK3CG (0.76) PLK1CDK5MEN1NPC1RAB9A
SCHEMBL4786087 0.84 PLK1 (0.78) PLK1CDK5MEN1NPC1RAB9A
SCHEMBL12275354 0.84 PIK3CG (0.67) CDK5MEN1NPC1RAB9AKMT2A
SCHEMBL4736832 0.83 PIK3CG (0.65) PLK1CDK5MEN1NPC1RAB9A
Ammonia Solution, Strong SCHEMBL5948439 0.83 PIK3CG (0.65) CDK5MEN1NPC1RAB9AKMT2A
SCHEMBL8489648 0.83 PIK3CG (0.76) PLK1CDK5MEN1NPC1RAB9A
SCHEMBL4732715 0.83 PIK3CG (0.61) PLK1CDK5MEN1NPC1RAB9A

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 16 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-20080153822-A1 Methods of treating pain INGENIUM PHARMACEUTICALS GMBH (DE) 2008-06-26 — — US disclosed
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 PLK1 1603/4885CDK5 737/4885MEN1 3759/4885
US-20080153822-A1 Methods of treating pain OPRL1, ACHE, OPRK1 PLK1 3544/4885CDK5 2587/4885MEN1 3807/4885

“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.

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