SCHEMBL4943281

SCHEMBL4943281

COc1cccc(N2c3ccccc3N(CC[C@H]3CO3)S2(=O)=O)c1

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 0.76
SLC6A4 P31645 9/20 0.76
SLC6A3 Q01959 11/20 0.60

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
SCHEMBL13673700 0.88 SLC6A2 (0.75) SLC6A2SLC6A4SLC6A3
SCHEMBL3598926 0.87 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
SCHEMBL3609478 0.87 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
SCHEMBL4056445 0.84 SLC6A2 (0.73) SLC6A2SLC6A4SLC6A3
SCHEMBL4061076 0.79 SLC6A2 (0.62) SLC6A2SLC6A4SLC6A3
SCHEMBL14088564 0.79 SLC6A2 (0.65) SLC6A2SLC6A4SLC6A3
SCHEMBL4942613 0.78 SLC6A2 (0.56) SLC6A2SLC6A4SLC6A3
SCHEMBL4060478 0.77 SLC6A2 (0.70) SLC6A2SLC6A4SLC6A3
SCHEMBL3609580 0.76 SLC6A2 (0.63) SLC6A2SLC6A4SLC6A3
SCHEMBL4061277 0.76 SLC6A2 (0.77) SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194654-A1 HYDROXY-SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-08-14 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-20080194654-A1 HYDROXY-SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, TPH1 SLC6A2 2/4885SLC6A4 1/4885SLC6A3 7/4885

“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.