SCHEMBL1633664

SCHEMBL1633664

C#Cc1cc2cnc(Nc3ccc(N4CCOCC4)cc3)nc2cc1OC1CCNCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 6/20 0.52
JAK2 O60674 5/20 0.52
SYK P43405 3/20 0.49
LRRK2 Q5S007 2/20 0.48
MAPK10 P53779 2/20 0.48
MYLK4 Q86YV6 1/20 0.46
STK17A Q9UEE5 1/20 0.46
IGF1R P08069 1/20 0.45
CDK4 P11802 4/20 0.45
CDK1 P06493 3/20 0.45
CCNB1 P14635 3/20 0.45
CCND1 P24385 3/20 0.45
CCNE1 P24864 3/20 0.45
CDK2 P24941 3/20 0.45
CCNB2 O95067 1/20 0.44
CCNE2 O96020 1/20 0.44
CCNA2 P20248 1/20 0.44
CCND2 P30279 1/20 0.44
CCND3 P30281 1/20 0.44
CCNA1 P78396 1/20 0.44

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
SCHEMBL1633826 0.92 TBK1 (0.62) TBK1JAK2SYKLRRK2
SCHEMBL12725013 0.87 LRRK2 (0.46) TBK1JAK2LRRK2MAPK10CDK4
SCHEMBL1634794 0.87 CDK4 (0.51) TBK1JAK2SYKLRRK2MAPK10
SCHEMBL1633015 0.87 CDK4 (0.51) TBK1JAK2SYKLRRK2MAPK10
SCHEMBL1632917 0.86 SYK (0.50) TBK1JAK2SYKLRRK2MAPK10
SCHEMBL1634528 0.86 SYK (0.47) TBK1JAK2SYKJAK3
SCHEMBL1860188 0.84 CDK4 (0.56) JAK2SYKLRRK2MAPK10CDK4
SCHEMBL1632749 0.83 JAK2 (0.50) TBK1JAK2SYKLRRK2CDK4
SCHEMBL1634307 0.83 MAPK10 (0.55) TBK1JAK2SYKLRRK2MAPK10
SCHEMBL1633417 0.82 MAPK10 (0.57) TBK1JAK2SYKLRRK2MAPK10

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 11 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
US-20100048561-A1 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2010-02-25 US disclosed
US-20100048561-A1 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2010-02-25 US disclosed
EP-2004615-A2 QUINAZOLINES FOR PDK1 INHIBITION Novartis AG (CH) 2008-12-24 EP disclosed
WO-2007117607-A9 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS VACCINES & DIAGNOSTIC (US) 2008-03-06 WO disclosed
WO-2007117607-A9 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS VACCINES & DIAGNOSTIC (US) 2008-03-06 WO disclosed
WO-2007117607-A2 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS AG (CH) 2007-10-18 WO disclosed
WO-2007117607-A2 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS AG (CH) 2007-10-18 WO 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 TBK1 539/4885JAK2 1352/4885SYK 4204/4885

“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.