SCHEMBL1102252

SCHEMBL1102252

CC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 1.00
MEN1 O00255 3/20 1.00
TDP1 Q9NUW8 1/20 0.70
PPIA P62937 2/20 0.70
TSHR P16473 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
LMNA P02545 1/20 0.68
AMY1A P0DUB6 1/20 0.68
ALDH1A1 P00352 2/20 0.66
KDM4E B2RXH2 1/20 0.66
RXFP1 Q9HBX9 1/20 0.66
POLB P06746 1/20 0.66
AKT1 P31749 1/20 0.66
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

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
SCHEMBL15113321 0.88 MEN1 (0.77) KMT2AMEN1TDP1TSHRSMN1; SMN2
SCHEMBL10031568 0.87 KMT2A (0.77) KMT2AMEN1TDP1PPIATSHR
SCHEMBL1102011 0.86 KMT2A (0.76) KMT2AMEN1TDP1PPIATSHR
SCHEMBL1101958 0.86 MEN1 (0.75) KMT2AMEN1TDP1PPIATSHR
SCHEMBL15116292 0.85 KMT2A (0.79) KMT2AMEN1TDP1LMNAALDH1A1
SCHEMBL879585 0.84 KMT2A (0.73) KMT2AMEN1TDP1PPIATSHR
SCHEMBL1091645 0.84 TDP1 (0.73) KMT2AMEN1TDP1PPIAALDH1A1
SCHEMBL1101963 0.84 LMNA (0.79) KMT2AMEN1TDP1PPIATSHR
SCHEMBL1351351 0.83 MEN1 (0.71) KMT2AMEN1TDP1PPIATSHR
SCHEMBL1091178 0.83 LMNA (0.74) KMT2AMEN1TDP1PPIATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20100087479-A1 Compositions Useful as Inhibitors of Voltage-Gated Sodium Channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-04-08 US disclosed
US-4120761-A ELECTROLYSIS OF ANHYDROUS PRIMARY ALCOHOL AND HYDROGEN CHLORIDE OR BROMIDE MONSANTO COMPANY (US) 1978-10-17 US 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 (1 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-20100087479-A1 Compositions Useful as Inhibitors of Voltage-Gated Sodium Channels SCNN1G, KCNN3, KCNN2 KMT2A 3111/4885MEN1 2329/4885TDP1 2356/4885

“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.