SCHEMBL1633709

SCHEMBL1633709

NC(=O)C1CCN(Cc2cccc3cnc(Nc4ccc(S(N)(=O)=O)cc4)nc23)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 4/20 0.47
▸ TYK2 P29597 3/20 0.45
▸ JAK2 O60674 1/20 0.45
▸ JAK1 P23458 1/20 0.45
▸ JAK3 P52333 1/20 0.45
▸ CDK1 P06493 4/20 0.43
▸ CDK2 P24941 4/20 0.43
▸ CDK9 P50750 4/20 0.43
▸ NTRK1 P04629 3/20 0.42
▸ TBK1 Q9UHD2 3/20 0.42
▸ CA2 P00918 3/20 0.42
▸ NUAK1 O60285 2/20 0.42
▸ STK16 O75716 2/20 0.42
▸ CSNK2A2 P19784 2/20 0.42
▸ AAK1 Q2M2I8 2/20 0.42
▸ BMP2K Q9NSY1 2/20 0.42
▸ CSF1R P07333 1/20 0.42
▸ ULK3 Q6PHR2 1/20 0.42
▸ IKBKE Q14164 1/20 0.42
▸ IKBKB O14920 2/20 0.42

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
SCHEMBL1633835 0.86 IKBKB (0.47) TYK2CDK1CDK2CDK9NTRK1
SCHEMBL1631354 0.84 TYK2 (0.54) SYKTYK2JAK2JAK1JAK3
SCHEMBL1633715 0.84 NTRK1 (0.42) SYKTYK2CDK1CDK2CDK9
SCHEMBL1633031 0.84 FGFR4 (0.47) TYK2CDK1CDK2CDK9NTRK1
SCHEMBL1632397 0.84 TBK1 (0.57) TYK2JAK2JAK3CDK1CDK2
SCHEMBL1633356 0.82 CDK1 (0.44) TYK2JAK2JAK1JAK3CDK1
SCHEMBL1633354 0.82 CDK1 (0.44) TYK2JAK2JAK1JAK3CDK1
SCHEMBL1633514 0.82 CDK1 (0.44) TYK2JAK2JAK1JAK3CDK1
SCHEMBL1632154 0.81 CDK2 (0.46) TYK2CDK1CDK2CDK9NTRK1
SCHEMBL1633063 0.79 IKBKB (0.53) CDK1CDK2CDK9CA2IKBKB

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 SYK 4204/4885TYK2 1796/4885JAK2 1352/4885

“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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