SCHEMBL1632149

SCHEMBL1632149

NS(=O)(=O)c1ccc(Nc2ncc3cc(C(F)(F)F)cc(-c4ccc(N5CCNC(=O)C5)nc4)c3n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 10/20 0.42
▸ CA2 P00918 10/20 0.42
▸ CA9 Q16790 10/20 0.42
▸ CA12 O43570 9/20 0.42
▸ JAK2 O60674 2/20 0.40
▸ JAK3 P52333 1/20 0.40
▸ PTK2 Q05397 1/20 0.40
▸ CA4 P22748 9/20 0.40
▸ CA7 P43166 8/20 0.40
▸ TRPV1 Q8NER1 4/20 0.40
▸ IKBKB O14920 2/20 0.39
▸ CHUK O15111 2/20 0.39
▸ PARP1 P09874 1/20 0.39
▸ STK4 Q13043 1/20 0.39
▸ SMG1 Q96Q15 1/20 0.38
▸ CDK1 P06493 3/20 0.38
▸ CCNT1 O60563 2/20 0.38
▸ CDK4 P11802 2/20 0.38
▸ CCNA2 P20248 2/20 0.38
▸ CCND1 P24385 2/20 0.38

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
SCHEMBL1632747 0.91 CA1 (0.41) CA1CA2CA9JAK2CA4
SCHEMBL1632843 0.89 IKBKB (0.42) CA1CA2CA9CA12JAK2
SCHEMBL1633022 0.86 MAPK10 (0.44) CA1CA2CA9CA12JAK2
SCHEMBL1631392 0.85 JAK2 (0.55) CA1CA2CA9CA12JAK2
SCHEMBL1633358 0.81 IKBKB (0.42) CA1CA2CA9CA12JAK2
SCHEMBL1634294 0.79 CA2 (0.44) CA1CA2CA9CA12PTK2
SCHEMBL1633189 0.77 SMG1 (0.50) CA1CA2CA9CA12JAK2
SCHEMBL1632659 0.77 CA1 (0.47) CA1CA2CA9CA12JAK2
SCHEMBL1632394 0.75 SMG1 (0.55) CA1CA2CA9CA12JAK2
SCHEMBL1632364 0.75 FGFR4 (0.48) CA1CA2CA9JAK2JAK3

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 CA1 4702/4885CA2 3577/4885CA9 4102/4885

“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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