SCHEMBL6783221

SCHEMBL6783221

CCCC[C@@]1(CC)CN(c2ccccc2)c2cc(Br)c(OCC(=O)O)cc2S(=O)(=O)C1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 19/20 0.45
NR1H4 Q96RI1 1/20 0.38

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
SCHEMBL5221836 1.00 SLC10A2 (0.45) SLC10A2NR1H4
SCHEMBL14559700 1.00 SLC10A2 (0.45) SLC10A2NR1H4
SCHEMBL3806806 0.96 SLC10A2 (0.44) SLC10A2NR1H4
SCHEMBL31176201 0.96 SLC10A2 (0.44) SLC10A2NR1H4
SCHEMBL6633251 0.94 SLC10A2 (0.41) SLC10A2NR1H4
SCHEMBL6309382 0.94 SLC10A2 (0.40) SLC10A2NR1H4
SCHEMBL14559698 0.92 SLC10A2 (0.38) SLC10A2NR1H4
SCHEMBL3806800 0.92 SLC10A2 (0.38) SLC10A2NR1H4
SCHEMBL22286487 0.92 SLC10A2 (0.43) SLC10A2NR1H4
SCHEMBL22286643 0.92 SLC10A2 (0.43) SLC10A2NR1H4

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-20040067933-A1 Chemical compounds ELOBIX AB (SE) 2004-04-08 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-20040067933-A1 Chemical compounds SLC10A2, SLC10A1, ABCB11 SLC10A2 1/4885NR1H4 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.