SCHEMBL4881144

SCHEMBL4881144

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

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.52
OPRD1 P41143 3/20 0.52
OPRK1 P41145 3/20 0.52
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HPGDS O60760 1/20 0.40
ALDH1A1 P00352 2/20 0.39
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA9 Q16790 3/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
ADAM17 P78536 2/20 0.37
MMP1 P03956 1/20 0.37
MMP9 P14780 1/20 0.37
MMP13 P45452 1/20 0.37
STS P08842 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
SCHEMBL4878341 0.87 OPRM1 (0.57) OPRM1OPRD1OPRK1KMT2AMEN1
SCHEMBL4872645 0.84 OPRD1 (0.56) OPRM1OPRD1OPRK1KMT2AMEN1
SCHEMBL4883886 0.84 L3MBTL1 (0.54) OPRM1KMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL4881139 0.82 OPRD1 (0.47) OPRM1OPRD1OPRK1KMT2AMEN1
SCHEMBL4880541 0.81 SOAT1 (0.48) OPRM1OPRD1OPRK1KMT2ASMN1; SMN2
SCHEMBL4876701 0.80 ALDH1A1 (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL4876644 0.79 SOAT1 (0.51) KMT2ACA12CA1CA2CA9
SCHEMBL4880472 0.79 STS (0.42) ALDH1A1CA12CA1CA2CA9
SCHEMBL4881113 0.78 SOAT1 (0.50) KMT2ACA12CA1CA2CA9
Hydrochloric Acid SCHEMBL4880951 0.78 SOAT1 (0.51) KMT2AMEN1CA12CA1CA2

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 OPRM1 1290/4885OPRD1 628/4885OPRK1 2515/4885

“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.