SCHEMBL3255280

SCHEMBL3255280

NS(=O)(=O)c1cccc(Nc2nccc(-c3c[nH]nc3-c3ccc(Cl)c(O)c3)n2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 2/20 0.53
▸ SLC2A1 P11166 1/20 0.52
▸ CDK1 P06493 11/20 0.49
▸ CDK9 P50750 7/20 0.49
▸ CCNT1 O60563 6/20 0.49
▸ CCNB1 P14635 6/20 0.49
▸ CDK2 P24941 7/20 0.49
▸ MTOR P42345 6/20 0.49
▸ PIK3CA P42336 1/20 0.49
▸ PIK3CG P48736 1/20 0.49
▸ SMG1 Q96Q15 5/20 0.48
▸ CCNA2 P20248 2/20 0.47
▸ CDK7 P50613 2/20 0.47
▸ CCNH P51946 2/20 0.47
▸ CCNA1 P78396 2/20 0.47
▸ GSK3B P49841 2/20 0.47
▸ CDK5 Q00535 2/20 0.47
▸ AURKA O14965 1/20 0.47
▸ MAP4K4 O95819 1/20 0.47
▸ ABL1 P00519 1/20 0.47

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
SCHEMBL3251254 0.89 CDK9 (0.55) IKBKBSLC2A1CDK1CDK9CCNT1
SCHEMBL3254956 0.83 CLK4 (0.52) IKBKBSLC2A1CDK1CDK9CCNT1
SCHEMBL3254964 0.82 CDK9 (0.55) IKBKBSLC2A1CDK1CDK9CCNT1
SCHEMBL3257066 0.81 SYK (0.49) PIK3CAPIK3CGGSK3BABL1FGFR1
SCHEMBL13359271 0.77 CDK9 (0.57) IKBKBSLC2A1CDK1CDK9CCNT1
SCHEMBL3253355 0.75 PIK3CG (0.47) CDK9CCNT1CDK2PIK3CAPIK3CG
SCHEMBL3255412 0.74 IKBKB (0.59) IKBKBCDK1CDK9CCNT1CCNB1
SCHEMBL3521890 0.73 CDK1 (0.62) IKBKBSLC2A1CDK1CDK9CCNT1
SCHEMBL7524252 0.72 CDK1 (0.69) IKBKBSLC2A1CDK1CDK9CCNT1
SCHEMBL7464681 0.72 CDK1 (0.61) IKBKBSLC2A1CDK1CDK9CCNT1

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
EP-1521749-B8 PHENYL-(4-(3-PHENYL-1H-PYRAZOL-4-YL)-PYRIMIDIN-2-Yl)-AMINE DERIVATIVES NOVARTIS AG (CH) 2010-12-22 — — EP claimed
EP-1521749-B1 PHENYL-(4-(3-PHENYL-1H-PYRAZOL-4-YL)-PYRIMIDIN-2-Yl)-AMINE DERIVATIVES NOVARTIS AG (CH) 2010-05-19 — — EP claimed
US-7691855-B2 Phenyl-[4-(3-phenyl-1h-pyrazol-4-yl)-pyrimidin-2-yl)-amine derivatives NOVARTIS AG (CH) 2010-04-06 — — US claimed
CN-1330643-C Phenyl-[4-(3-phenyl-1h-pyrazol-4-yl)-pyrimidin-2-yl)-amine derivatives NOVARTIS AG (CH) 2007-08-08 — — CN claimed
US-20060106027-A1 Phenyl-[4-(3-phenyl-1h-pyrazol-4-yl)-pyrimidin-2-yI)-amine derivatives FURET PASCAL 2006-05-18 — — US claimed
CN-1668610-A Phenyl-[4-(3-phenyl-1h-pyrazol-4-yl)-pyrimidin-2-yl)-amine derivatives NOVARTIS AG (CH) 2005-09-14 — — CN claimed
EP-1521749-A1 PHENYL-(4-(3-PHENYL-1H-PYRAZOL-4-YL)-PYRIMIDIN-2-Yl)-AMINE DERIVATIVES Novartis AG (CH) 2005-04-13 — — EP claimed
WO-2004005282-A1 PHENYL-[4-(3-PHENYL-1H-PYRAZOL-4-YL)-PYRIMIDIN-2-Yl)-AMINE DERIVATIVES NOVARTIS AG (CH) 2004-01-15 — — WO claimed
EP-1521749-B1 PHENYL-(4-(3-PHENYL-1H-PYRAZOL-4-YL)-PYRIMIDIN-2-Yl)-AMINE DERIVATIVES NOVARTIS AG (CH) 2010-05-19 — — EP disclosed
US-7691855-B2 Phenyl-[4-(3-phenyl-1h-pyrazol-4-yl)-pyrimidin-2-yl)-amine derivatives NOVARTIS AG (CH) 2010-04-06 — — US disclosed
US-7691855-B2 Phenyl-[4-(3-phenyl-1h-pyrazol-4-yl)-pyrimidin-2-yl)-amine derivatives NOVARTIS AG (CH) 2010-04-06 — — US disclosed
US-7691855-B2 Phenyl-[4-(3-phenyl-1h-pyrazol-4-yl)-pyrimidin-2-yl)-amine derivatives NOVARTIS AG (CH) 2010-04-06 — — US disclosed
US-20060106027-A1 Phenyl-[4-(3-phenyl-1h-pyrazol-4-yl)-pyrimidin-2-yI)-amine derivatives FURET PASCAL 2006-05-18 — — US 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-20060106027-A1 Phenyl-[4-(3-phenyl-1h-pyrazol-4-yl)-pyrimidin-2-yI)-amine derivatives MKI67, CCNI, PAH IKBKB 442/4885SLC2A1 2851/4885CDK1 75/4885

“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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