SCHEMBL1633868

SCHEMBL1633868

NS(=O)(=O)c1ccc(Nc2ncc3cccc(-c4ccc(N5CCOCC5)nc4)c3n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 7/20 0.57
JUN P05412 5/20 0.55
MAPK8 P45983 5/20 0.55
JAK2 O60674 3/20 0.55
SMG1 Q96Q15 2/20 0.54
CA12 O43570 5/20 0.53
CA1 P00915 5/20 0.53
CA2 P00918 5/20 0.53
CA9 Q16790 5/20 0.53
FLT3 P36888 1/20 0.50
CDK1 P06493 1/20 0.48
CDK2 P24941 1/20 0.48
MTOR P42345 1/20 0.48
JAK3 P52333 1/20 0.47
CNR2 P34972 2/20 0.46

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
SCHEMBL1633314 0.92 MAPK10 (0.49) MAPK10JUNMAPK8JAK2SMG1
SCHEMBL1633192 0.89 JAK2 (0.55) MAPK10JUNMAPK8JAK2SMG1
SCHEMBL12724257 0.88 MAPK10 (0.46) MAPK10JUNMAPK8JAK2SMG1
SCHEMBL1631108 0.88 SMG1 (0.70) MAPK10JUNMAPK8JAK2SMG1
SCHEMBL13498291 0.88 MAPK10 (0.46) MAPK10JUNMAPK8JAK2SMG1
SCHEMBL1632394 0.88 SMG1 (0.55) MAPK10JAK2SMG1CA12CA1
SCHEMBL1633943 0.87 MAPK10 (0.47) MAPK10JUNMAPK8JAK2CA12
SCHEMBL1633145 0.85 MAPK10 (0.55) MAPK10JUNMAPK8JAK2CDK2
SCHEMBL1633022 0.84 MAPK10 (0.44) MAPK10JUNMAPK8JAK2SMG1
SCHEMBL1632167 0.83 MAPK10 (0.57) MAPK10JUNMAPK8JAK2MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932262-B2 Quinazolines for PDK1 inhibition NOVARTIS AG (CH) 2011-04-26 US disclosed
US-7932262-B2 Quinazolines for PDK1 inhibition NOVARTIS AG (CH) 2011-04-26 US disclosed
US-7932262-B2 Quinazolines for PDK1 inhibition NOVARTIS AG (CH) 2011-04-26 US disclosed
US-20100048561-A1 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2010-02-25 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-20100048561-A1 QUINAZOLINES FOR PDK1 INHIBITION PDK1, PDK2, PDK3 MAPK10 402/4885JUN 544/4885MAPK8 267/4885

“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.