SCHEMBL1619865

SCHEMBL1619865

COc1ccc(S(=O)(=O)c2cccc(Cl)n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 2/20 0.57
▸ PKM P14618 5/20 0.55
▸ HTT P42858 2/20 0.54
▸ POLB P06746 2/20 0.54
▸ AKR1B1 P15121 1/20 0.49
▸ GAA P10253 2/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ RAPGEF4 Q8WZA2 1/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ PKLR P30613 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ FFAR4 Q5NUL3 1/20 0.42
▸ CYP19A1 P11511 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ PIK3CA P42336 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ KMT2A Q03164 1/20 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
SCHEMBL7971332 0.82 GAA (0.50) PKMHTTAKR1B1GAASMN1; SMN2
SCHEMBL1573955 0.80 TSHR (0.48) NFE2L2PKMHTTAKR1B1SMN1; SMN2
SCHEMBL7969618 0.79 HTT (0.50) NFE2L2PKMHTTAKR1B1SMN1; SMN2
SCHEMBL1620183 0.79 NFE2L2 (0.54) NFE2L2PKMHTTAKR1B1GAA
SCHEMBL22966173 0.76 PKM (0.51) PKMHTTPOLBAKR1B1GAA
SCHEMBL7958580 0.75 KMT2A (0.44) PKMPOLBMEN1KMT2AKDM4E
SCHEMBL7274163 0.74 PKM (0.63) NFE2L2PKMHTTPOLBAKR1B1
SCHEMBL28270265 0.74 PKM (0.68) PKMHTTPOLBAKR1B1GAA
SCHEMBL13074716 0.73 PKM (1.00) PKMHTTPOLBAKR1B1GAA
SCHEMBL835692 0.73 PKM (1.00) PKMHTTPOLBAKR1B1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2183232-B1 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC (US) 2013-03-06 — — EP disclosed
US-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 — — US disclosed
US-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 — — US disclosed
US-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 — — US disclosed
EP-2183232-A2 PI3 KINASE MODULATORS AND METHODS OF USE Amgen, Inc (US) 2010-05-12 — — EP disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 — — US disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 — — US disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 — — US disclosed
WO-2009017822-A2 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2009-02-05 — — WO disclosed
WO-2009017822-A2 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2009-02-05 — — WO disclosed
WO-2001017965-A2 CYANOPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 — — 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-20090054405-A1 PI3 kinase modulators and methods of use PIK3CA, PIK3C2A, PIK3C2B NFE2L2 1893/4885PKM 729/4885HTT 4580/4885

“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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