SCHEMBL4177556

SCHEMBL4177556

O=C(NCc1ccc(C(F)(F)F)cc1)c1ccc(S(=O)(=O)Cl)nc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LSS P48449 1/20 0.54
SCN3A Q9NY46 1/20 0.53
MAPK14 Q16539 1/20 0.52
PPARD Q03181 3/20 0.52
HDAC1 Q13547 4/20 0.51
KDM1A O60341 3/20 0.51
PSMD14 O00487 1/20 0.51
STAMBP O95630 1/20 0.51
HDAC3 O15379 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
EPHX2 P34913 3/20 0.49
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
RORC P51449 2/20 0.48
ROCK2 O75116 1/20 0.48
VNN1 O95497 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL3161276 0.85 TSHR (0.56) MAPK14PPARDHDAC1HDAC3HDAC2
SCHEMBL3154608 0.85 SCN3A (0.61) LSSSCN3AMAPK14HDAC1KDM1A
SCHEMBL3162987 0.83 L3MBTL1 (0.69) LSSMAPK14HDAC1KDM1APSMD14
SCHEMBL3168267 0.80 LSS (0.59) LSSSCN3AMAPK14HDAC1KDM1A
SCHEMBL13450241 0.80 LSS (0.59) LSSSCN3AMAPK14HDAC1KDM1A
SCHEMBL3169361 0.79 SCN3A (0.79) LSSSCN3AMAPK14HDAC1KDM1A
SCHEMBL507529 0.76 LSS (0.68) LSSMAPK14HDAC1KDM1AEPHX2
SCHEMBL20477571 0.76 MEN1 (0.73) LSSMAPK14EPHX2PPARGPPARA
SCHEMBL16495525 0.76 HPGDS (0.77) LSSMAPK14HDAC1KDM1APSMD14
SCHEMBL16495492 0.75 HPGDS (0.60) LSSMAPK14HDAC1KDM1APSMD14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8741934-B2 Inhibitors of ion channels PFIZER LIMITED (GB) 2014-06-03 US disclosed
US-8741934-B2 Inhibitors of ion channels PFIZER LIMITED (GB) 2014-06-03 US disclosed
US-20130072471-A1 Inhibitors of Ion Channels MARRON BRIAN EDWARD (US) 2013-03-21 US disclosed
US-20130072471-A1 Inhibitors of Ion Channels MARRON BRIAN EDWARD (US) 2013-03-21 US disclosed
US-8357711-B2 Heterocyclic sulfonamides as inhibitors of ion channels PFIZER LIMITED (GB) 2013-01-22 US disclosed
US-8357711-B2 Heterocyclic sulfonamides as inhibitors of ion channels PFIZER LIMITED (GB) 2013-01-22 US disclosed
US-8357711-B2 Heterocyclic sulfonamides as inhibitors of ion channels PFIZER LIMITED (GB) 2013-01-22 US disclosed
EP-1995241-B1 Inhibitors of ion channels ICAGEN INC (US) 2010-03-17 EP disclosed
US-20090143358-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (US) 2009-06-04 US disclosed
US-20090143358-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (US) 2009-06-04 US disclosed
US-20090143358-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (US) 2009-06-04 US disclosed
EP-1995241-A1 Inhibitors of ion channels ICAgen, Incorporated (US) 2008-11-26 EP disclosed
WO-2008118758-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (GB) 2008-10-02 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 (2 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-20130072471-A1 Inhibitors of Ion Channels TRPV1, TRPV5, TRPA1 LSS 1559/4885SCN3A 13/4885MAPK14 1400/4885
US-20090143358-A1 INHIBITORS OF ION CHANNELS TRPV1, TRPV5, TRPA1 LSS 1559/4885SCN3A 13/4885MAPK14 1400/4885

“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.