SCHEMBL3108566

SCHEMBL3108566

Cc1ccc(S(=O)(=O)n2cc(Br)c(-c3ccccc3)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
ALDH1A1 P00352 2/20 0.60
LMNA P02545 2/20 0.60
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
NR1H2 P55055 1/20 0.49
NR1H3 Q13133 1/20 0.49
PIK3CD O00329 1/20 0.46
PIK3CA P42336 1/20 0.46
PIK3CB P42338 1/20 0.46
PIK3CG P48736 1/20 0.46
NPSR1 Q6W5P4 3/20 0.46
TSHR P16473 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
GAA P10253 2/20 0.44
MCOLN3 Q8TDD5 1/20 0.44
HSD11B1 P28845 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41

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
SCHEMBL28216516 0.86 MAPT (0.63) MAPTSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL3685134 0.79 MEN1 (0.54) MAPTSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL18976162 0.77 MEN1 (0.67) MAPTSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL18976161 0.77 MEN1 (0.51) MAPTSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL18976160 0.73 KMT2A (0.48) MAPTSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL2578089 0.72 MAPT (0.57) MAPTSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL13953681 0.72 MEN1 (0.47) MAPTSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL30302198 0.72 NR1H2 (0.49) MAPTSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL22558313 0.71 MAPT (0.56) MAPTSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL12253466 0.69 NR1H2 (0.56) MAPTSMN1; SMN2ALDH1A1LMNAMEN1

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 6 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
EP-2173354-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS GlaxoSmithKline LLC (US) 2010-04-14 EP disclosed
EP-2154965-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS Glaxosmithkline LLC (US) 2010-02-24 EP disclosed
WO-2009021083-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-02-12 WO disclosed
WO-2009021083-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-02-12 WO 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 MAPT 3160/4885SMN1; SMN2 1226/4885ALDH1A1 3084/4885

“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.