SCHEMBL15524940

SCHEMBL15524940

COC(=O)c1ccc(Oc2cccc(-c3ccc(OC)cc3)c2)c(S(N)(=O)=O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.54
CA1 P00915 3/20 0.54
CA2 P00918 3/20 0.54
CA9 Q16790 3/20 0.54
F10 P00742 2/20 0.50
PKM P14618 1/20 0.46
PLAU P00749 3/20 0.46
PLAT P00750 3/20 0.46
PLG P00747 2/20 0.46
P2RX4 Q99571 2/20 0.46
ACLY P53396 1/20 0.45
CA14 Q9ULX7 2/20 0.45
CYP2C9 P11712 1/20 0.45
KMT2A Q03164 1/20 0.44
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
TCF4 P15884 1/20 0.43
CTNNB1 P35222 1/20 0.43
PTGES2 Q9H7Z7 1/20 0.43

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
SCHEMBL15525729 0.83 TBXA2R (0.58) PLAUPLAT
SCHEMBL9436735 0.82 PKM (0.56) CA12CA1CA2CA9F10
SCHEMBL16375994 0.82 P2RX4 (0.48) P2RX4ACLYCYP2C9PTGES2
SCHEMBL19039475 0.82 WDR5 (0.46) CA2CA9F10PLAUP2RX4
SCHEMBL18574241 0.80 P2RX4 (0.41) F10PLAUP2RX4CYP1A2POLB
SCHEMBL19039474 0.79 AR (0.46) CA12CA1CA2CA9F10
SCHEMBL19625141 0.79 PLG (0.48) F10PLAUPLATPLGACLY
SCHEMBL16376159 0.78 TBXA2R (0.52) F10PLAUKMT2APOLB
SCHEMBL21962198 0.77 PKM (0.74) CA12CA1CA2CA9PKM
SCHEMBL15525704 0.76 CA2 (0.56) CA12CA1CA2CA9CA14

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 41 patents — showing the first 20. 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
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-20170298020-A1 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS AND VIRAL INFECTIONS ATXA THERAPEUTICS LIMITED (IE) 2017-10-19 US 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-9738599-B2 Thromboxane receptor antagonists UNIVERSITY COLLEGE DUBLIN, NATIONAL UNIVERSITY OF IRELAND, DUBLIN (IE) 2017-08-22 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-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-20160102051-A1 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS AND VIRAL INFECTIONS ATXA THERAPEUTICS LIMITED (IE) 2016-04-14 US disclosed
US-20160016900-A1 THROMBOXANE RECEPTOR ANTAGONISTS ATXA THERAPEUTICS LIMITED (IE) 2016-01-21 US disclosed
US-20160016900-A1 THROMBOXANE RECEPTOR ANTAGONISTS ATXA THERAPEUTICS LIMITED (IE) 2016-01-21 US disclosed
US-20160016900-A1 THROMBOXANE RECEPTOR ANTAGONISTS ATXA THERAPEUTICS LIMITED (IE) 2016-01-21 US disclosed
EP-2838520-A2 THROMBOXANE RECEPTOR ANTAGONISTS University College Dublin National University Of Ireland, Dublin (IE) 2015-02-25 EP 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
WO-2013156871-A9 THROMBOXANE RECEPTOR ANTAGONISTS UNIVERSITY COLLEGE DUBLIN, NATIONAL UNIVERSITY OF IRELAND, DUBLIN (IE) 2015-01-08 WO 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 (3 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 CA12 4381/4885CA1 4728/4885CA2 3111/4885
US-20170298020-A1 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS AND VIRAL INFECTIONS TBXA2R, PTGFR, TBXAS1 CA12 4381/4885CA1 4728/4885CA2 3111/4885
US-20160016900-A1 THROMBOXANE RECEPTOR ANTAGONISTS TBXA2R, TBXAS1, PTGIR CA12 4434/4885CA1 4340/4885CA2 2497/4885

“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.