SCHEMBL7204720

SCHEMBL7204720

CC(C)(C)OC(=O)n1cc(-c2cc(Nc3ccc(S(N)(=O)=O)cc3)n[nH]2)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 15/20 0.47
CDK1 P06493 8/20 0.47
PIM1 P11309 1/20 0.40
MARK3 P27448 1/20 0.40
MAP4K2 Q12851 1/20 0.40
CAMK2B Q13554 1/20 0.40
PIM3 Q86V86 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
EEF2K O00418 1/20 0.39
ROCK2 O75116 1/20 0.39
MAP4K4 O95819 1/20 0.39
CLK2 P49760 1/20 0.39
GSK3B P49841 1/20 0.39
PRKX P51817 1/20 0.39
NEK4 P51957 1/20 0.39
PRKG2 Q13237 1/20 0.39
ROCK1 Q13464 1/20 0.39
PKN2 Q16513 1/20 0.39
TAOK1 Q7L7X3 1/20 0.39
AURKB Q96GD4 1/20 0.39

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
SCHEMBL7207115 0.89 PIM1 (0.44) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL29965821 0.78 TNIK (0.55)
SCHEMBL21262418 0.78 TNIK (0.55)
SCHEMBL29965861 0.77 TNIK (0.57) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL21262419 0.77 TNIK (0.57) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL7204485 0.70 TNIK (0.60) CDK2CDK1
SCHEMBL7545155 0.66 CDK2 (0.60) CDK2CDK1
SCHEMBL21246906 0.65 L3MBTL1 (0.59) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL22864734 0.64 L3MBTL1 (0.55) PIM1MARK3MAP4K2CAMK2BPIM3
SCHEMBL29558678 0.64 L3MBTL1 (0.55) PIM1MARK3MAP4K2CAMK2BPIM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1274706-A1 PYRAZOLES FOR INHIBITING PROTEIN KINASES AGOURON PHARMACEUTICALS, INC. (US) 2003-01-15 EP disclosed
US-6462069-B2 KINASE INHIBITORS; ANTICANCER AGENTS AGOURON PHARMACEUTICALS, INC. 2002-10-08 US disclosed
WO-2001079198-A9 PYRAZOLES FOR INHIBITING PROTEIN KINASE AGOURON PHARMA (US) 2002-05-16 WO disclosed
US-20020006952-A1 Compounds, pharmaceutical compositions, and methods for inhibiting protein kinases LIGHPOINTE COMMUNICATION, INC. 2002-01-17 US disclosed
WO-2001079198-A1 PYRAZOLES FOR INHIBITING PROTEIN KINASE AGOURON PHARMACEUTICALS, INC. (US) 2001-10-25 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-20020006952-A1 Compounds, pharmaceutical compositions, and methods for inhibiting protein kinases CDK3, CCNK, CDK1 CDK2 4/4885CDK1 3/4885PIM1 450/4885

“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.