SCHEMBL1633715

SCHEMBL1633715

NC(=O)C1CCN(Cc2cncc(-c3cccc4cnc(Nc5ccc(S(N)(=O)=O)cc5)nc34)c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 3/20 0.42
▸ TBK1 Q9UHD2 3/20 0.42
▸ IKBKE Q14164 1/20 0.42
▸ CDK1 P06493 1/20 0.42
▸ CDK2 P24941 1/20 0.42
▸ CDK9 P50750 1/20 0.42
▸ SYK P43405 3/20 0.42
▸ NUAK1 O60285 1/20 0.41
▸ STK16 O75716 1/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ CSNK2A2 P19784 1/20 0.41
▸ TYK2 P29597 1/20 0.41
▸ AAK1 Q2M2I8 1/20 0.41
▸ ULK3 Q6PHR2 1/20 0.41
▸ BMP2K Q9NSY1 1/20 0.41
▸ FGFR2 P21802 1/20 0.41
▸ IKBKB O14920 4/20 0.41
▸ MAPK10 P53779 1/20 0.40
▸ AXL P30530 1/20 0.40
▸ MERTK Q12866 1/20 0.40

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 0.89 IKBKB (0.46) NTRK1TBK1IKBKECDK1CDK2
SCHEMBL1633057 0.87 EGFR (0.51) NTRK1TBK1CDK1CDK2CDK9
SCHEMBL1633524 0.86 JAK2 (0.50) NTRK1TBK1NUAK1STK16CSF1R
SCHEMBL1634505 0.86 TBK1 (0.55) NTRK1TBK1IKBKECDK1NUAK1
SCHEMBL13498247 0.85 IKBKB (0.44) NTRK1TBK1IKBKECDK1CDK2
SCHEMBL1633709 0.84 SYK (0.47) NTRK1TBK1IKBKECDK1CDK2
SCHEMBL1632740 0.81 CYP11B2 (0.42) NTRK1TBK1CDK1CDK2CDK9
SCHEMBL1634316 0.77 TBK1 (0.57) NTRK1TBK1IKBKENUAK1STK16
SCHEMBL1632276 0.77 NTRK1 (0.42) NTRK1TBK1IKBKESYKNUAK1
SCHEMBL13498295 0.76 MTOR (0.62) NTRK1TBK1CDK1CDK2CDK9

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 NTRK1 1997/4885TBK1 539/4885IKBKE 707/4885

“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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