SCHEMBL1102011

SCHEMBL1102011

O=C(Cl)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.76
MEN1 O00255 4/20 0.76
PPIA P62937 2/20 0.70
SMN1; SMN2 Q16637 3/20 0.68
LMNA P02545 2/20 0.68
TSHR P16473 2/20 0.68
TDP1 Q9NUW8 1/20 0.67
SCN3A Q9NY46 2/20 0.65
SCN1A P35498 1/20 0.65
SCN4A P35499 1/20 0.65
SCN5A Q14524 1/20 0.65
SCN9A Q15858 1/20 0.65
SCN2A Q99250 1/20 0.65
SCN8A Q9UQD0 1/20 0.65
SCN10A Q9Y5Y9 1/20 0.65
MAPK1 P28482 1/20 0.65
CYP3A4 P08684 1/20 0.65
PTGS1 P23219 1/20 0.65
AVPR2 P30518 1/20 0.65
GPR27 Q9NS67 1/20 0.65

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
SCHEMBL1102252 0.86 KMT2A (1.00) KMT2AMEN1PPIASMN1; SMN2LMNA
SCHEMBL1091178 0.86 LMNA (0.74) KMT2AMEN1PPIASMN1; SMN2LMNA
SCHEMBL879585 0.84 KMT2A (0.73) KMT2AMEN1PPIASMN1; SMN2LMNA
SCHEMBL1091420 0.84 LMNA (0.79) KMT2AMEN1PPIASMN1; SMN2LMNA
SCHEMBL1091645 0.84 TDP1 (0.73) KMT2AMEN1PPIATDP1SCN3A
SCHEMBL10031625 0.83 KMT2A (0.71) KMT2AMEN1PPIASMN1; SMN2LMNA
SCHEMBL1101958 0.83 MEN1 (0.75) KMT2AMEN1PPIASMN1; SMN2LMNA
SCHEMBL10031568 0.82 KMT2A (0.77) KMT2AMEN1PPIASMN1; SMN2LMNA
SCHEMBL17689190 0.82 MEN1 (0.79) KMT2AMEN1SMN1; SMN2LMNATSHR
SCHEMBL15116290 0.82 KMT2A (0.74) KMT2AMEN1PPIASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130184258-A1 Compositions Useful as Inhibitors of Voltage-Gated Sodium Channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-07-18 US disclosed
US-8309543-B2 Compositions useful as inhibitors of voltage-gated sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-11-13 US disclosed
US-20120238578-A1 COMPOSITIONS USEFUL AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-09-20 US disclosed
US-8202861-B2 Drugs for various disorders VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-06-19 US disclosed
US-8202861-B2 Drugs for various disorders VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-06-19 US disclosed
US-8153655-B2 Compositions useful as inhibitors of voltage-gated sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-04-10 US disclosed
EP-2332912-A1 Heteroarylaminosulfonylphenylderivates for use as sodium or calcium channel blockers in the treatment of pain VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-15 EP disclosed
EP-2327701-A1 Heteroarylaminosulfonylphenyl derivatives for use as sodium or calcium channel blockers in the treatment of pain VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-01 EP disclosed
US-20100087479-A1 Compositions Useful as Inhibitors of Voltage-Gated Sodium Channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-04-08 US disclosed
US-7615563-B2 Compositions useful as inhibitors of voltage-gated sodium channels VERTEX PHARMACEUTICALS INCORPORATED 2009-11-10 US disclosed
US-20060025415-A1 Compositions useful as inhibitors of voltage-gated sodium channels VERTEX PHARMACEUTICALS INCORPORATED 2006-02-02 US disclosed
WO-2005013914-A2 HETEROARYLAMINOSULFONYLPHENYL DERIVATIVES FOR USE AS SODIUM OR CALCIUM CHANNEL BLOCKERS IN THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2005-02-17 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 (4 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-20120238578-A1 COMPOSITIONS USEFUL AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS SCNN1G, KCNN3, KCNN2 KMT2A 3111/4885MEN1 2329/4885PPIA 2483/4885
US-20100087479-A1 Compositions Useful as Inhibitors of Voltage-Gated Sodium Channels SCNN1G, KCNN3, KCNN2 KMT2A 3111/4885MEN1 2329/4885PPIA 2483/4885
US-20060025415-A1 Compositions useful as inhibitors of voltage-gated sodium channels SCNN1G, KCNN3, KCNN2 KMT2A 3111/4885MEN1 2329/4885PPIA 2483/4885
US-20130184258-A1 Compositions Useful as Inhibitors of Voltage-Gated Sodium Channels SCNN1G, KCNN3, KCNN2 KMT2A 3111/4885MEN1 2329/4885PPIA 2483/4885

“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.