SCHEMBL4880646

SCHEMBL4880646

COc1cccc(C2(C(=O)OS(N)(=O)=O)CCN(c3ncccc3OC)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 2/20 0.40
MALT1 Q9UDY8 2/20 0.39
OPRD1 P41143 1/20 0.39
KCNH2 Q12809 1/20 0.39
PKLR P30613 1/20 0.39
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.37
SOAT1 P35610 2/20 0.37
LIMK2 P53671 1/20 0.37
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37

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
SCHEMBL4880943 0.88 MALT1 (0.45) MALT1OPRD1KCNH2ALDH1A1LMNA
SCHEMBL4876701 0.87 ALDH1A1 (0.50) ALDH1A1LMNAHPGD
SCHEMBL4876766 0.86 KMT2A (0.46) MALT1OPRD1KCNH2ALDH1A1LMNA
SCHEMBL4876644 0.84 SOAT1 (0.51) SOAT1
SCHEMBL4880637 0.84 MALT1 (0.41) MALT1OPRD1KCNH2PKLRALDH1A1
Hydrochloric Acid SCHEMBL4880951 0.83 SOAT1 (0.51) SOAT1
SCHEMBL4881113 0.83 SOAT1 (0.50) SOAT1
SCHEMBL4880541 0.81 SOAT1 (0.48) OPRD1ALDH1A1SOAT1
SCHEMBL4876387 0.79 SOAT1 (0.47) SOAT1
SCHEMBL4880472 0.76 STS (0.42) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080096922-A1 Novel Sulfonamide derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-04-24 US disclosed
EP-1736467-A1 NOVEL SULFONAMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-12-27 EP 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-20080096922-A1 Novel Sulfonamide derivative NR4A1, NR4A2, NR4A3 SCN10A 1115/4885MALT1 2298/4885OPRD1 628/4885

“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.