SCHEMBL2331086

SCHEMBL2331086

Cc1cccc(Nc2nccc(-c3ccnc(C)c3)n2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 6/20 0.70
PIK3CA P42336 5/20 0.70
ABL1 P00519 3/20 0.70
BCR P11274 3/20 0.70
CDK2 P24941 3/20 0.64
CDK1 P06493 2/20 0.64
SMG1 Q96Q15 1/20 0.64
SRC P12931 3/20 0.62
ZAP70 P43403 2/20 0.62
SYK P43405 2/20 0.62
CCNB2 O95067 1/20 0.60
RET P07949 1/20 0.60
CCNB1 P14635 1/20 0.60
CCNB3 Q8WWL7 1/20 0.60
PIK3CB P42338 4/20 0.59
DYRK1A Q13627 1/20 0.56
CAMK2D Q13557 2/20 0.55
PLK1 P53350 2/20 0.52
FLT1 P17948 1/20 0.51
FLT4 P35916 1/20 0.51

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
SCHEMBL2322043 1.00 PIK3CG (0.70) PIK3CGPIK3CAABL1BCRCDK2
Hydrochloric Acid SCHEMBL16496538 0.99 PIK3CG (0.69) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL27115444 0.88 PIK3CA (0.69) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL7467324 0.88 ABL1 (0.76) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL2329574 0.87 ABL1 (0.61) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL7813342 0.87 PIK3CA (0.67) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL2328157 0.87 CAMK2D (0.70) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL27115445 0.86 PIK3CG (0.66) PIK3CGPIK3CAABL1BCRCDK2
Water SCHEMBL7813855 0.85 PIK3CA (0.65) PIK3CGPIK3CAABL1BCRCDK2
SCHEMBL2324992 0.85 PIK3CG (0.76) PIK3CGPIK3CAABL1BCRCDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110294810-A1 SUBSTITUTED (PYRIDYL)-AZINYLAMINE DERIVATIVES AS PLANT PROTECTION AGENTS BAYER CROPSCIENCE AG (DE) 2011-12-01 US claimed
WO-1999035140-A1 PYRIDINYLPYRIMIDINE AMINES AS IMMUNOGLOBULINE E (IgE) SYNTHESIS INHIBITORS NOVARTIS AG (CH) 1999-07-15 WO claimed
US-20110294810-A1 SUBSTITUTED (PYRIDYL)-AZINYLAMINE DERIVATIVES AS PLANT PROTECTION AGENTS BAYER CROPSCIENCE AG (DE) 2011-12-01 US disclosed
EP-2356102-A1 SUBSTITUTED (PYRIDYL)-AZINYLAMINE DERIVATIVES AS PLANT PROTECTION AGENTS Bayer CropScience AG (DE) 2011-08-17 EP disclosed
WO-2010055114-A1 SUBSTITUTED (PYRIDYL)-AZINYLAMINE DERIVATIVES AS PLANT PROTECTION AGENTS BAYER CROPSCIENCE SA (FR) 2010-05-20 WO disclosed
WO-1999035140-A1 PYRIDINYLPYRIMIDINE AMINES AS IMMUNOGLOBULINE E (IgE) SYNTHESIS INHIBITORS NOVARTIS AG (CH) 1999-07-15 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 (1 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-20110294810-A1 SUBSTITUTED (PYRIDYL)-AZINYLAMINE DERIVATIVES AS PLANT PROTECTION AGENTS PRXL2A, AZI2, PIR PIK3CG 2330/4885PIK3CA 1630/4885ABL1 801/4885

“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.