SCHEMBL4881333

SCHEMBL4881333

COc1cccc([C@]2(CNS(=O)(=O)NC(=O)O)CC[C@@H](NC(C)c3ccc(-c4ccccc4)cc3)CC2)c1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 12/20 0.40
SLC6A4 P31645 6/20 0.40
SOAT1 P35610 6/20 0.40
KCNH2 Q12809 5/20 0.40
ALDH1A1 P00352 1/20 0.39
ACACB O00763 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
SCHEMBL4881335 1.00 NPY1R (0.40) NPY1RSLC6A4SOAT1KCNH2ALDH1A1
SCHEMBL4875891 0.88 NPY1R (0.40) NPY1RSLC6A4SOAT1KCNH2ALDH1A1
SCHEMBL4875901 0.88 NPY1R (0.40) NPY1RSLC6A4SOAT1KCNH2ALDH1A1
Hydrochloric Acid SCHEMBL4868453 0.87 NPY1R (0.40) NPY1RSLC6A4SOAT1KCNH2ALDH1A1
Hydrochloric Acid SCHEMBL4868441 0.87 NPY1R (0.40) NPY1RSLC6A4SOAT1KCNH2ALDH1A1
SCHEMBL4876775 0.87 ALDH1A1 (0.42) SOAT1ALDH1A1
SCHEMBL4876769 0.87 ALDH1A1 (0.42) SOAT1ALDH1A1
SCHEMBL4878196 0.85 MMP1 (0.42) NPY1RSOAT1KCNH2ALDH1A1
SCHEMBL4871944 0.85 MMP1 (0.42) NPY1RSOAT1KCNH2ALDH1A1
SCHEMBL4871938 0.85 MMP1 (0.42) NPY1RSOAT1KCNH2ALDH1A1

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 NPY1R 338/4885SLC6A4 632/4885SOAT1 502/4885

“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.