SCHEMBL1651879

SCHEMBL1651879

COc1ccc(-c2cn(S(=O)(=O)c3ccccc3)c3ccccc23)cc1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 14/20 0.74
▸ CA12 O43570 1/20 0.68
▸ CA1 P00915 1/20 0.68
▸ CA2 P00918 1/20 0.68
▸ CA9 Q16790 1/20 0.68
▸ L3MBTL1 Q9Y468 1/20 0.66
▸ ELAVL1 Q15717 1/20 0.56
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ HTR2A P28223 3/20 0.53
▸ HTR7 P34969 2/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ CYP2D6 P10635 1/20 0.53
▸ DRD2 P14416 1/20 0.52
▸ LMNA P02545 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL28984412 0.91 L3MBTL1 (0.77) HTR6CA12CA1CA2CA9
SCHEMBL19737472 0.87 HTR6 (0.66) HTR6L3MBTL1HTR2AHTR7DRD2
SCHEMBL19737552 0.87 HTR6 (0.55) HTR6CA12CA1CA2CA9
SCHEMBL3644542 0.86 HTR6 (1.00) HTR6CA12CA1CA2CA9
Dimethylamine SCHEMBL21222407 0.84 HTR6 (0.65) HTR6L3MBTL1HTR2AHTR7DRD2
SCHEMBL4338217 0.84 HTR6 (0.65) HTR6CA12CA1CA2CA9
SCHEMBL19737624 0.82 HTR6 (0.63) HTR6HTR2AHTR7DRD2
SCHEMBL3044328 0.82 ELAVL1 (0.51) HTR6CA12CA1CA2CA9
SCHEMBL7497252 0.82 HTR6 (0.74) HTR6CA12CA1CA2CA9
SCHEMBL13302272 0.80 HTR6 (0.62) HTR6L3MBTL1HTR2AHTR7DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2486010-B1 ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2019-06-12 — — EP disclosed
EP-2486010-B1 ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2019-06-12 — — EP disclosed
US-8710243-B2 Estrogen receptor ligands KARO BIO AB (SE) 2014-04-29 — — US disclosed
EP-2486010-A2 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2012-08-15 — — EP disclosed
US-20120202861-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2012-08-09 — — US disclosed
US-20120202861-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2012-08-09 — — US disclosed
US-20120202861-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2012-08-09 — — US disclosed
WO-2011042473-A2 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 — — WO disclosed
WO-2011042473-A2 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 — — WO disclosed
US-7411082-B2 Synthesizing method for compound, and catalyst for synthesis reaction CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LTD. (GB) 2008-08-12 — — 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-20120202861-A1 NOVEL ESTROGEN RECEPTOR LIGANDS ESR1, ESRRA, GPER1 HTR6 951/4885CA12 2226/4885CA1 1953/4885

“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.

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