SCHEMBL2910089

SCHEMBL2910089

Cc1ccccc1S(=O)(=O)N1CCc2cc(OCCCN3CCCCC3)sc2C1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 16/20 0.51
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ HRH1 P35367 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
SCHEMBL2907653 0.99 HRH3 (0.49) HRH3CYP2D6CYP2C19ALDH1A1HRH1
SCHEMBL1422969 0.93 HRH3 (0.51) HRH3CYP2D6CYP2C19ALDH1A1
SCHEMBL1422964 0.92 HRH3 (0.49) HRH3CYP2D6CYP2C19ALDH1A1
SCHEMBL2942874 0.90 HRH3 (0.45) HRH3CYP2D6CYP2C19ALDH1A1
SCHEMBL2913820 0.87 HRH3 (0.67) HRH3HRH1
SCHEMBL2906731 0.85 HRH3 (0.66) HRH3ALDH1A1HRH1
SCHEMBL2907958 0.85 HRH3 (0.55) HRH3ALDH1A1
SCHEMBL2913121 0.84 HRH3 (0.64) HRH3
SCHEMBL2907126 0.84 HRH3 (0.53) HRH3ALDH1A1
SCHEMBL2913246 0.84 KMT2A (0.38) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2102215-B1 4,5,6,7-TETRAHYDRO-THIENO [2,3-C]PYRIDINES AS H3 MODULATORS HOFFMANN LA ROCHE (CH) 2010-09-01 — — EP claimed
US-20080146559-A1 4,5,6,7-Tetrahydro-Thieno [2,3-C] Pyridine Derivatives F. HOFFMANN-LA ROCHE AG (CH) 2008-06-19 — — US claimed
EP-2102215-B1 4,5,6,7-TETRAHYDRO-THIENO [2,3-C]PYRIDINES AS H3 MODULATORS HOFFMANN LA ROCHE (CH) 2010-09-01 — — EP disclosed
US-20080146559-A1 4,5,6,7-Tetrahydro-Thieno [2,3-C] Pyridine Derivatives F. HOFFMANN-LA ROCHE AG (CH) 2008-06-19 — — 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-20080146559-A1 4,5,6,7-Tetrahydro-Thieno [2,3-C] Pyridine Derivatives HRH4, HRH3, HRH2 HRH3 2/4885CYP2D6 412/4885CYP2C19 451/4885

“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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