SCHEMBL3108650

SCHEMBL3108650

CN(C)S(=O)(=O)c1cc(-c2ccc3ncc(F)c(-c4ccncc4)c3n2)cnc1N

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.44
PIK3CA P42336 2/20 0.38
AKT1 P31749 1/20 0.38
ALOX5AP P20292 3/20 0.36
FEN1 P39748 3/20 0.36
MAP4K4 O95819 10/20 0.36
MINK1 Q8N4C8 2/20 0.36
TNIK Q9UKE5 2/20 0.36
MAPT P10636 1/20 0.34
MELK Q14680 2/20 0.33

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
SCHEMBL3115836 0.83 PIK3CA (0.51) PIK3C3PIK3CAAKT1ALOX5APFEN1
SCHEMBL3074529 0.77 PIK3CA (0.47) PIK3C3PIK3CAAKT1ALOX5APFEN1
SCHEMBL3121364 0.76 PIK3CA (0.43) PIK3C3PIK3CAAKT1ALOX5APFEN1
SCHEMBL13271698 0.74 PIK3CA (0.42) PIK3C3PIK3CAAKT1ALOX5APFEN1
SCHEMBL3108641 0.73 MAP4K4 (0.42) PIK3C3PIK3CAAKT1ALOX5APFEN1
SCHEMBL3112863 0.72 LRRK2 (0.38) PIK3C3PIK3CAAKT1MAP4K4MELK
SCHEMBL3121729 0.71 CA9 (0.42) PIK3C3PIK3CAAKT1MAP4K4
SCHEMBL3119875 0.71 PIK3C3 (0.40) PIK3C3PIK3CAAKT1ALOX5APFEN1
SCHEMBL3117706 0.71 PIK3CA (0.40) PIK3C3PIK3CAAKT1ALOX5APFEN1
SCHEMBL729100 0.71 PIK3CA (0.53) PIK3C3PIK3CAAKT1ALOX5APFEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100179143-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2010-07-15 US disclosed
US-20100179143-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2010-07-15 US disclosed
US-20100179143-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2010-07-15 US disclosed
EP-2154965-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS Glaxosmithkline LLC (US) 2010-02-24 EP disclosed
WO-2008150827-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-12-11 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-20100179143-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS INPP5D, PI4KA, PTEN PIK3C3 19/4885PIK3CA 6/4885AKT1 78/4885

“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.