SCHEMBL1633611

SCHEMBL1633611

NS(=O)(=O)c1ccc(Nc2ncc3ccc(-c4cccc(S(N)(=O)=O)c4)cc3n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.54
GSK3B P49841 2/20 0.52
DKK1 O94907 1/20 0.52
IKBKB O14920 6/20 0.51
MAP4K1 Q92918 2/20 0.48
ENPP3 O14638 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
CDK1 P06493 4/20 0.47
CDK2 P24941 4/20 0.47
CCNT1 O60563 3/20 0.47
CCNB1 P14635 3/20 0.47
CDK9 P50750 3/20 0.47
CDK7 P50613 1/20 0.47
CCNH P51946 1/20 0.47
PTK2 Q05397 1/20 0.47
CCNA2 P20248 2/20 0.47
CCNE1 P24864 2/20 0.47
CDK5 Q00535 2/20 0.47
CCND3 P30281 1/20 0.47

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
SCHEMBL1632940 0.93 PTK2 (0.56) SYKGSK3BDKK1IKBKBMAP4K1
SCHEMBL1633311 0.89 CA2 (0.56) SYKGSK3BDKK1IKBKBMAP4K1
SCHEMBL1634189 0.88 MAPK8 (0.56) SYKGSK3BDKK1IKBKBMAP4K1
SCHEMBL1632246 0.87 SYK (0.50) SYKGSK3BDKK1IKBKBMAP4K1
SCHEMBL1632476 0.86 MAP3K5 (0.57) SYKGSK3BDKK1IKBKBMAP4K1
SCHEMBL1633521 0.86 BRAF (0.54) SYKGSK3BDKK1IKBKBCDK1
SCHEMBL1634389 0.85 IKBKB (0.49) SYKGSK3BDKK1IKBKBCA2
SCHEMBL13498325 0.84 IKBKB (0.54) SYKGSK3BDKK1IKBKBCA2
SCHEMBL1631337 0.84 CA1 (0.48) SYKGSK3BDKK1IKBKBCA2
SCHEMBL1632143 0.83 MAP4K1 (0.58) GSK3BDKK1IKBKBMAP4K1CA2

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 4204/4885GSK3B 453/4885DKK1 1228/4885

“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.