SCHEMBL1632155

SCHEMBL1632155

NS(=O)(=O)c1ccc(Nc2ncc3cccc(-c4cncc(CN5CCCC5)c4)c3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 2/20 0.46
▸ NTRK1 P04629 5/20 0.45
▸ TBK1 Q9UHD2 4/20 0.45
▸ TYK2 P29597 4/20 0.45
▸ CSF1R P07333 2/20 0.45
▸ NUAK1 O60285 2/20 0.45
▸ STK16 O75716 2/20 0.45
▸ CSNK2A2 P19784 2/20 0.45
▸ AAK1 Q2M2I8 2/20 0.45
▸ BMP2K Q9NSY1 2/20 0.45
▸ ULK3 Q6PHR2 1/20 0.45
▸ MTOR P42345 1/20 0.43
▸ SMG1 Q96Q15 1/20 0.43
▸ CDK1 P06493 3/20 0.43
▸ KDR P35968 2/20 0.43
▸ IKBKE Q14164 1/20 0.43
▸ CA1 P00915 3/20 0.43
▸ CA2 P00918 3/20 0.43
▸ CA9 Q16790 3/20 0.43
▸ CA4 P22748 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
SCHEMBL1634505 0.92 TBK1 (0.55) IKBKBNTRK1TBK1TYK2CSF1R
SCHEMBL1633524 0.92 JAK2 (0.50) IKBKBNTRK1TBK1TYK2CSF1R
SCHEMBL13498247 0.91 IKBKB (0.44) IKBKBNTRK1TBK1TYK2CSF1R
SCHEMBL1633057 0.89 EGFR (0.51) IKBKBNTRK1TBK1TYK2CSF1R
SCHEMBL1633715 0.89 NTRK1 (0.42) IKBKBNTRK1TBK1TYK2CSF1R
SCHEMBL1632740 0.87 CYP11B2 (0.42) IKBKBNTRK1TBK1TYK2CSF1R
SCHEMBL1633768 0.83 PTK2 (0.45) IKBKBNTRK1CDK1KDRCA1
SCHEMBL1634316 0.82 TBK1 (0.57) NTRK1TBK1TYK2CSF1RNUAK1
SCHEMBL1633835 0.82 IKBKB (0.47) IKBKBNTRK1TBK1TYK2CSF1R
SCHEMBL1633266 0.82 BRAF (0.52) IKBKBMTORSMG1CA1CA2

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 IKBKB 980/4885NTRK1 1997/4885TBK1 539/4885

“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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