SCHEMBL4736128

SCHEMBL4736128

COc1ccc(-c2ccnc(Nc3ccc(O)cc3)n2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 6/20 0.76
▸ PIK3CA P42336 5/20 0.76
▸ PIK3CB P42338 5/20 0.76
▸ MEN1 O00255 6/20 0.71
▸ KMT2A Q03164 6/20 0.71
▸ IKBKB O14920 3/20 0.68
▸ NPC1 O15118 4/20 0.66
▸ MAPT P10636 3/20 0.66
▸ RAB9A P51151 3/20 0.62
▸ CDK5 Q00535 2/20 0.62
▸ CDK5R1 Q15078 1/20 0.62
▸ ALDH1A1 P00352 2/20 0.59
▸ MAPK1 P28482 2/20 0.59
▸ LMNA P02545 1/20 0.59
▸ PLK1 P53350 2/20 0.58
▸ VCP P55072 1/20 0.57
▸ CHUK O15111 1/20 0.57
▸ GAA P10253 1/20 0.56
▸ NFKB1 P19838 1/20 0.56
▸ NFKB2 Q00653 1/20 0.56

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
SCHEMBL7465398 0.86 PIK3CG (0.76) PIK3CGPIK3CAPIK3CBMEN1KMT2A
SCHEMBL10977837 0.86 PIK3CG (0.78) PIK3CGPIK3CAPIK3CBMEN1KMT2A
SCHEMBL4385401 0.85 JAK2 (0.76) PIK3CGPIK3CAPIK3CBMEN1KMT2A
SCHEMBL4733859 0.85 PIK3CG (0.80) PIK3CGPIK3CAPIK3CBMEN1KMT2A
SCHEMBL4735284 0.85 PLK1 (0.70) PIK3CGPIK3CAPIK3CBMEN1KMT2A
SCHEMBL4737479 0.83 PLK1 (0.61) PIK3CGPIK3CAPIK3CBMEN1KMT2A
Iodide SCHEMBL7477268 0.83 PIK3CG (0.70) PIK3CGPIK3CAPIK3CBMEN1KMT2A
SCHEMBL7464281 0.83 PIK3CG (0.70) PIK3CGPIK3CAPIK3CBMEN1KMT2A
SCHEMBL27643199 0.82 PIK3CA (0.74) PIK3CGPIK3CAPIK3CBMEN1KMT2A
SCHEMBL4738430 0.82 PIK3CG (0.69) PIK3CGPIK3CAPIK3CBMEN1KMT2A

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 15 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
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.

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