SCHEMBL302891

SCHEMBL302891

O=S(=O)(c1cccnc1)N(Cc1ccccc1)c1cccc(N2CCN(c3ccccc3)CC2)c1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.66
HTR7 P34969 5/20 0.60
HTR1A P08908 4/20 0.60
HTR2A P28223 4/20 0.60
DRD3 P35462 4/20 0.60
HTR6 P50406 4/20 0.60
CYP11B1 P15538 1/20 0.49
CNR2 P34972 3/20 0.47
GRM2 Q14416 4/20 0.47
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
CNR1 P21554 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL1966437 0.89 HTR7 (0.69) HTR2CHTR7HTR1AHTR2ADRD3
SCHEMBL302050 0.85 HTR2C (0.53) HTR2CHTR7HTR1AHTR2ADRD3
SCHEMBL301830 0.82 HTR2C (0.61) HTR2CHTR7HTR1AHTR2ADRD3
SCHEMBL3279825 0.81 CYP11B1 (0.53) HTR2CCYP11B1GRM2ALDH1A1LMNA
SCHEMBL2188998 0.79 ALDH1A1 (0.70) CYP11B1GRM2ALDH1A1LMNAMEN1
SCHEMBL13064496 0.77 LMNA (0.58) CNR2ALDH1A1LMNAMEN1KMT2A
SCHEMBL13065208 0.76 LMNA (0.59) HTR2CGRM2LMNAKMT2A
SCHEMBL303179 0.75 HTR2C (0.54) HTR2CHTR7HTR1AHTR2ADRD3
SCHEMBL303614 0.75 HTR2C (0.58) HTR2CHTR7HTR1AHTR2ADRD3
SCHEMBL303069 0.75 HTR2C (0.55) HTR2CHTR7HTR1AHTR2ADRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2334637-B1 NOVEL POTASSIUM CHANNEL BLOCKERS JAPAN TOBACCO INC (JP) 2017-01-04 EP claimed
US-8372840-B2 Potassium channel blockers XENTION LIMITED (GB) 2013-02-12 US claimed
JP-2012500835-A 2012-01-12 JP claimed
EP-2334637-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-06-22 EP claimed
US-20100087438-A1 New Potassium Channel Blockers XENTION LIMITED (GB) 2010-04-08 US claimed
WO-2010023446-A1 NOVEL POTASSIUM CHANNEL BLOCKERS XENTION LIMITED (GB) 2010-03-04 WO claimed
EP-2334637-B1 NOVEL POTASSIUM CHANNEL BLOCKERS JAPAN TOBACCO INC (JP) 2017-01-04 EP disclosed
US-8372840-B2 Potassium channel blockers XENTION LIMITED (GB) 2013-02-12 US disclosed
EP-2334637-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-06-22 EP disclosed
US-20100087438-A1 New Potassium Channel Blockers XENTION LIMITED (GB) 2010-04-08 US disclosed
WO-2010023446-A1 NOVEL POTASSIUM CHANNEL BLOCKERS XENTION LIMITED (GB) 2010-03-04 WO 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-20100087438-A1 New Potassium Channel Blockers KCNJ2, KCNB1, KCNJ11 HTR2C 3430/4885HTR7 2622/4885HTR1A 1235/4885

“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.