SCHEMBL15055682

SCHEMBL15055682

O=C(OCCCCN1CCOCC1)c1ccc(NS(=O)(=O)c2cccc(-c3ccc4c(c3)CCO4)c2)cc1OC(=O)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.40
PTGES2 Q9H7Z7 1/20 0.39
EGFR P00533 2/20 0.38
MET P08581 2/20 0.38
PFKFB3 Q16875 1/20 0.36
TRPV4 Q9HBA0 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RORC P51449 1/20 0.35
NR3C1 P04150 1/20 0.35
PKM P14618 1/20 0.35
PKLR P30613 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34

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
SCHEMBL15056373 0.98 EPHX2 (0.42) EPHX2PTGES2EGFRMETPFKFB3
Trifluoroacetic Acid SCHEMBL15055687 0.89 PFKFB3 (0.44) EPHX2PTGES2EGFRMETPFKFB3
SCHEMBL15080001 0.88 PFKFB3 (0.46) EPHX2PTGES2EGFRMETPFKFB3
Trifluoroacetic Acid SCHEMBL15056377 0.87 PFKFB3 (0.45) EPHX2PTGES2EGFRMETPFKFB3
SCHEMBL15079993 0.86 PFKFB3 (0.47) EPHX2PTGES2EGFRMETPFKFB3
SCHEMBL15055731 0.84 PFKFB3 (0.48) EPHX2EGFRMETPFKFB3TRPV4
SCHEMBL15055146 0.84 PFKFB3 (0.47) EPHX2EGFRMETPFKFB3TRPV4
SCHEMBL15055724 0.84 PFKFB3 (0.57) EPHX2EGFRMETPFKFB3TRPV4
SCHEMBL15055040 0.84 PFKFB3 (0.41) EPHX2PFKFB3PTGS1PTGS2
SCHEMBL15056192 0.82 PFKFB3 (0.49) EPHX2EGFRMETPFKFB3PTGS2

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
US-20160221938-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2016-08-04 US claimed
US-20150025068-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2015-01-22 US claimed
EP-2794009-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER Kancera AB (SE) 2014-10-29 EP claimed
WO-2013093095-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2013-06-27 WO claimed
US-10000449-B2 Bisarylsulfonamides useful in the treatment of inflammation and cancer KANCERA AB (SE) 2018-06-19 US disclosed
EP-2794009-B1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2017-08-30 EP disclosed
US-9718809-B2 Bisarylsulfonamides useful in the treatment of inflammation and cancer KANCERA AB (SE) 2017-08-01 US disclosed
US-20160221938-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2016-08-04 US disclosed
US-20150025068-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2015-01-22 US disclosed
EP-2794009-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER Kancera AB (SE) 2014-10-29 EP disclosed
WO-2013093095-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2013-06-27 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-20150025068-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER NFKBIA, IL6, LITAF EPHX2 2619/4885PTGES2 86/4885EGFR 980/4885
US-20160221938-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER NFKBIA, IL6, LITAF EPHX2 2645/4885PTGES2 96/4885EGFR 1092/4885
US-10000449-B2 Bisarylsulfonamides useful in the treatment of inflammation and cancer NFKBIA, IL6, LITAF EPHX2 2645/4885PTGES2 96/4885EGFR 1092/4885

“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.