SCHEMBL4876705

SCHEMBL4876705

COc1cccc(C2(C(=O)NS(=O)(=O)O)CCC(O)(c3ccccc3)CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 3/20 0.46
OPRM1 P35372 2/20 0.46
OPRK1 P41145 2/20 0.46
OPRL1 P41146 2/20 0.46
ALDH1A1 P00352 2/20 0.45
GRIN2B Q13224 3/20 0.43
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ELOVL1 Q9BW60 1/20 0.41
HSD11B1 P28845 1/20 0.41
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40

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
SCHEMBL4880460 0.84 ELOVL1 (0.43) ALDH1A1KMT2AMEN1ELOVL1
SCHEMBL4880349 0.84 HDAC4 (0.46) OPRD1OPRK1ALDH1A1GRIN2BKMT2A
SCHEMBL4880538 0.84 SOAT1 (0.50) ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL4877598 0.84 OPRD1 (0.41) OPRD1OPRK1ALDH1A1GRIN2BKMT2A
SCHEMBL4878256 0.83 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1SMN1; SMN2ELOVL1
SCHEMBL4877673 0.82 KMT2A (0.42) ALDH1A1GRIN2BKMT2AMEN1SMN1; SMN2
SCHEMBL4880120 0.82 KMT2A (0.41) OPRD1ALDH1A1KMT2AMEN1ELOVL1
SCHEMBL4883883 0.81 MMP1 (0.52) ALDH1A1
SCHEMBL4876712 0.80 OPRD1 (0.46) OPRD1OPRM1OPRK1OPRL1ALDH1A1
SCHEMBL4876634 0.79 SOAT1 (0.52) KMT2ADRD2

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 OPRD1 628/4885OPRM1 1290/4885OPRK1 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.