SCHEMBL1633192

SCHEMBL1633192

CN1CCN(c2ccc(-c3cccc4cnc(Nc5ccc(S(N)(=O)=O)cc5)nc34)cn2)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.55
BRD4 O60885 1/20 0.55
MAPK10 P53779 5/20 0.49
EGFR P00533 2/20 0.49
MTOR P42345 1/20 0.48
SMG1 Q96Q15 1/20 0.48
IKBKB O14920 2/20 0.48
AURKA O14965 3/20 0.46
JUN P05412 2/20 0.46
MAPK8 P45983 1/20 0.46
FGFR4 P22455 2/20 0.46
PIK3CD O00329 1/20 0.45
DCLK1 O15075 1/20 0.45
PIK3C2G O75747 1/20 0.45
PIK3CG P48736 1/20 0.45
MAPK7 Q13164 1/20 0.45
LRRK2 Q5S007 1/20 0.45
AURKB Q96GD4 1/20 0.45
CCNT1 O60563 2/20 0.45
CCNB2 O95067 2/20 0.45

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
SCHEMBL1633314 0.92 MAPK10 (0.49) JAK2BRD4MAPK10MTORSMG1
SCHEMBL1633943 0.90 MAPK10 (0.47) JAK2BRD4MAPK10EGFRIKBKB
SCHEMBL12724257 0.90 MAPK10 (0.46) JAK2BRD4MAPK10EGFRSMG1
SCHEMBL1633868 0.89 MAPK10 (0.57) JAK2MAPK10MTORSMG1JUN
SCHEMBL1632115 0.89 JAK2 (0.66) JAK2BRD4EGFRAURKAFGFR4
SCHEMBL1632085 0.88 SMG1 (0.62) JAK2BRD4EGFRMTORSMG1
SCHEMBL13498291 0.88 MAPK10 (0.46) JAK2BRD4MAPK10EGFRSMG1
SCHEMBL1632364 0.88 FGFR4 (0.48) JAK2BRD4MTORSMG1IKBKB
SCHEMBL1633048 0.87 MAPK10 (0.66) JAK2BRD4MAPK10EGFRJUN
SCHEMBL1633145 0.86 MAPK10 (0.55) JAK2BRD4MAPK10EGFRJUN

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 268/4885MAPK10 402/4885

“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.