SCHEMBL15524946

SCHEMBL15524946

NC(=O)N(Br)S(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3G Q9HC16 1/20 0.47
KMT2A Q03164 3/20 0.46
HSD11B1 P28845 2/20 0.46
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
PLA2G7 Q13093 1/20 0.41
CA9 Q16790 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 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
SCHEMBL11526542 0.80 KMT2A (0.59) APOBEC3GKMT2AHSD11B1TSHRSMN1; SMN2
SCHEMBL7924261 0.79 APOBEC3G (0.50) APOBEC3GKMT2AHSD11B1CA12CA1
SCHEMBL11034530 0.79 APOBEC3G (0.50) APOBEC3GKMT2AHSD11B1CA12CA1
SCHEMBL11524385 0.78 HSD11B1 (0.62) APOBEC3GKMT2AHSD11B1TSHRSMN1; SMN2
SCHEMBL8579922 0.78 APOBEC3G (0.48) APOBEC3GKMT2AHSD11B1CA12CA1
SCHEMBL728027 0.78 APOBEC3G (0.48) APOBEC3GKMT2AHSD11B1CA12CA1
SCHEMBL3069669 0.78 APOBEC3G (0.48) APOBEC3GKMT2AHSD11B1CA12CA1
SCHEMBL27540835 0.76 HSD11B1 (0.65) APOBEC3GKMT2AHSD11B1CA12CA9
SCHEMBL30244490 0.74 APOBEC3G (0.45) APOBEC3GKMT2AHSD11B1CA12CA1
SCHEMBL174224 0.74 KMT2A (0.62) APOBEC3GKMT2AHSD11B1CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2838519-B1 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS AND VIRAL INFECTIONS UNIV COLLEGE DUBLIN NAT UNIV OF IRELAND DUBLIN (IE) 2017-11-22 EP disclosed
US-20170298020-A1 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS AND VIRAL INFECTIONS ATXA THERAPEUTICS LIMITED (IE) 2017-10-19 US disclosed
US-9738599-B2 Thromboxane receptor antagonists UNIVERSITY COLLEGE DUBLIN, NATIONAL UNIVERSITY OF IRELAND, DUBLIN (IE) 2017-08-22 US disclosed
US-9718781-B2 Methods and compounds for treating proliferative disorders and viral infections UNIVERSITY COLLEGE DUBLIN, NATIONAL UNIVERSITY OF IRELAND, DUBLIN (IE) 2017-08-01 US disclosed
US-20170183300-A1 THROMBOXANE RECEPTOR ANTAGONISTS ATXA THERAPEUTICS LIMITED (IE) 2017-06-29 US disclosed
US-9630915-B2 Thromboxane receptor antagonists UNIVERSITY COLLEGE DUBLIN, NATIONAL UNIVERSITY OF IRELAND, DUBLIN (IE) 2017-04-25 US disclosed
US-20170057913-A1 THROMBOXANE RECEPTOR ANTAGONISTS ATXA THERAPEUTICS LIMITED (IE) 2017-03-02 US disclosed
US-9522877-B2 Thromboxane receptor antagonists UNIVERSITY COLLEGE DUBLIN, NATIONAL UNIVERSITY OF IRELAND, DUBLIN (IE) 2016-12-20 US disclosed
US-20160280640-A1 THROMBOXANE RECEPTOR ANTAGONISTS ATXA THERAPEUTICS LIMITED (IE) 2016-09-29 US disclosed
US-20160102051-A1 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS AND VIRAL INFECTIONS ATXA THERAPEUTICS LIMITED (IE) 2016-04-14 US disclosed
EP-2838519-A2 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS AND VIRAL INFECTIONS University College Dublin National University Of Ireland, Dublin (IE) 2015-02-25 EP disclosed
EP-2838520-A2 THROMBOXANE RECEPTOR ANTAGONISTS University College Dublin National University Of Ireland, Dublin (IE) 2015-02-25 EP disclosed
WO-2013156871-A9 THROMBOXANE RECEPTOR ANTAGONISTS UNIVERSITY COLLEGE DUBLIN, NATIONAL UNIVERSITY OF IRELAND, DUBLIN (IE) 2015-01-08 WO disclosed
WO-2013156871-A2 THROMBOXANE RECEPTOR ANTAGONISTS UNIVERSITY COLLEGE DUBLIN, NATIONAL UNIVERSITY OF IRELAND, DUBLIN (IE) 2013-10-24 WO disclosed
WO-2013156861-A2 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS AND VIRAL INFECTIONS UNIVERSITY COLLEGE DUBLIN, NATIONAL UNIVERSITY OF IRELAND, DUBLIN (IE) 2013-10-24 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 (5 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-20160102051-A1 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS AND VIRAL INFECTIONS TBXA2R, PTGFR, TBXAS1 APOBEC3G 2159/4885KMT2A 1962/4885HSD11B1 1534/4885
US-20170298020-A1 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS AND VIRAL INFECTIONS TBXA2R, PTGFR, TBXAS1 APOBEC3G 2159/4885KMT2A 1962/4885HSD11B1 1534/4885
US-20170183300-A1 THROMBOXANE RECEPTOR ANTAGONISTS TBXA2R, TBXAS1, PTGIR APOBEC3G 3584/4885KMT2A 2845/4885HSD11B1 3016/4885
US-20170057913-A1 THROMBOXANE RECEPTOR ANTAGONISTS TBXA2R, TBXAS1, PTGIR APOBEC3G 3584/4885KMT2A 2845/4885HSD11B1 3016/4885
US-20160280640-A1 THROMBOXANE RECEPTOR ANTAGONISTS TBXA2R, TBXAS1, PTGIR APOBEC3G 3584/4885KMT2A 2845/4885HSD11B1 3016/4885

“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.