SCHEMBL398719

SCHEMBL398719

O=C(O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.71
TSHR P16473 1/20 0.71
PTK2B Q14289 1/20 0.71
KMT2A Q03164 2/20 0.69
ALDH1A1 P00352 3/20 0.62
MAPK1 P28482 2/20 0.62
LMNA P02545 2/20 0.61
AKR1C3 P42330 2/20 0.60
CASP3 P42574 1/20 0.58
SENP8 Q96LD8 1/20 0.58
SENP7 Q9BQF6 1/20 0.58
SENP6 Q9GZR1 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
RAB9A P51151 1/20 0.57
MEN1 O00255 1/20 0.57
MAPT P10636 1/20 0.57
PKM P14618 1/20 0.57
HPGD P15428 1/20 0.57
MPI P34949 1/20 0.57
APOBEC3G Q9HC16 1/20 0.57

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
SCHEMBL399983 0.85 AKR1C3 (0.59) KDM4ETSHRPTK2BKMT2AAKR1C3
SCHEMBL7373672 0.83 KDM4E (1.00) KDM4ETSHRPTK2BKMT2AALDH1A1
SCHEMBL3724899 0.82 FABP4 (0.59) KDM4ETSHRPTK2BKMT2AALDH1A1
SCHEMBL17978438 0.82 USP2 (0.77) KDM4ETSHRPTK2BKMT2AALDH1A1
SCHEMBL2568299 0.81 RECQL (0.58) TSHRKMT2AALDH1A1MEN1
SCHEMBL399038 0.81 ALDH1A1 (0.60) KDM4ETSHRKMT2AALDH1A1MAPK1
SCHEMBL13076401 0.81 THRB (0.55) KDM4ETSHRPTK2BKMT2AALDH1A1
SCHEMBL30702319 0.80 PFKFB3 (0.76) KDM4ETSHRPTK2BKMT2AAKR1C3
SCHEMBL30702318 0.80 PFKFB3 (0.76) KDM4ETSHRPTK2BKMT2AAKR1C3
SCHEMBL4063367 0.80 PFKFB3 (0.76) KDM4ETSHRPTK2BKMT2AAKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382191-B1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBVIE BAHAMAS LTD (BS) 2014-11-12 EP disclosed
US-8741899-B2 (4-chloro-2-fluoro-N-(2-fluorophenyl)-5-[(8aR)-hexahydropyrrolo-[1,2-a]pyrazin-2(1H)-ylcarbonyl]-benzenesulfonamide, and pharmaceutically acceptable salts thereof ABBVIE INC. (US) 2014-06-03 US disclosed
US-20130210827-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBVIE INC. (US) 2013-08-15 US disclosed
US-8404719-B2 Substituted piperidinylcarbonylbenzenesulfonamides as calcium channel blockers ABBVIE INC. (US) 2013-03-26 US disclosed
US-20120083499-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBOTT LABORATORIES (US) 2012-04-05 US disclosed
US-8101614-B2 Substituted pyrrolo [1,2-a] pyrazines as calcium channel blockers ABBOTT LABORATORIES (US) 2012-01-24 US disclosed
EP-2382191-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS Abbott Laboratories, Inc. (US) 2011-11-02 EP disclosed
US-20100197693-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBOTT LABORATORIES (US) 2010-08-05 US disclosed
WO-2010083264-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBOTT LABORATORIES (US) 2010-07-22 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-20130210827-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS CACNA1E, RYR2, RYR1 KDM4E 2172/4885TSHR 1660/4885PTK2B 2760/4885
US-20120083499-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS CACNA1E, RYR2, RYR1 KDM4E 2172/4885TSHR 1660/4885PTK2B 2760/4885
US-20100197693-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS CACNA1E, RYR2, RYR1 KDM4E 2172/4885TSHR 1660/4885PTK2B 2760/4885

“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.