SCHEMBL1633524

SCHEMBL1633524

CN1CCN(Cc2cncc(-c3cccc4cnc(Nc5ccc(S(N)(=O)=O)cc5)nc34)c2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 7/20 0.50
▸ BRD4 O60885 1/20 0.50
▸ FGFR4 P22455 1/20 0.49
▸ AXL P30530 6/20 0.49
▸ FGFR1 P11362 1/20 0.47
▸ JAK3 P52333 5/20 0.46
▸ PTK2 Q05397 4/20 0.46
▸ IKBKB O14920 2/20 0.45
▸ NUAK1 O60285 1/20 0.43
▸ STK16 O75716 1/20 0.43
▸ NTRK1 P04629 1/20 0.43
▸ CSF1R P07333 1/20 0.43
▸ CSNK2A2 P19784 1/20 0.43
▸ TYK2 P29597 1/20 0.43
▸ AAK1 Q2M2I8 1/20 0.43
▸ ULK3 Q6PHR2 1/20 0.43
▸ BMP2K Q9NSY1 1/20 0.43
▸ TBK1 Q9UHD2 1/20 0.43
▸ EGFR P00533 1/20 0.43
▸ FGFR2 P21802 1/20 0.43

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
SCHEMBL1632155 0.92 IKBKB (0.46) JAK2BRD4FGFR1JAK3PTK2
SCHEMBL1633057 0.90 EGFR (0.51) JAK2BRD4FGFR4JAK3IKBKB
SCHEMBL13498247 0.90 IKBKB (0.44) JAK2BRD4FGFR4AXLFGFR1
SCHEMBL1634505 0.90 TBK1 (0.55) JAK2JAK3PTK2IKBKBNUAK1
SCHEMBL1633715 0.86 NTRK1 (0.42) AXLPTK2IKBKBNUAK1STK16
SCHEMBL1632740 0.85 CYP11B2 (0.42) JAK2BRD4FGFR1JAK3IKBKB
SCHEMBL1633031 0.83 FGFR4 (0.47) FGFR4AXLFGFR1PTK2IKBKB
SCHEMBL1632623 0.82 MAPK10 (0.53) JAK2BRD4FGFR4AXLIKBKB
SCHEMBL18376798 0.81 JAK2 (0.55) JAK2BRD4FGFR4AXLFGFR1
SCHEMBL1633192 0.81 JAK2 (0.55) JAK2BRD4FGFR4IKBKBEGFR

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 JAK2 1352/4885BRD4 268/4885FGFR4 2040/4885

“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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