SCHEMBL5097435

SCHEMBL5097435

COC1CCN(c2cccc(S(=O)(=O)n3nc(C)c4ccc(N5CCNCC5)cc43)c2)C1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KHK P50053 11/20 0.48
HTR6 P50406 9/20 0.41
HTR1A P08908 2/20 0.41
DRD2 P14416 2/20 0.41
HTR2A P28223 2/20 0.41
HTR7 P34969 2/20 0.41

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
SCHEMBL5097430 1.00 KHK (0.48) KHKHTR6HTR1ADRD2HTR2A
SCHEMBL5103767 0.89 KHK (0.50) KHKHTR6HTR1ADRD2HTR2A
SCHEMBL14140307 0.89 HTR6 (0.40) KHKHTR6HTR1ADRD2HTR2A
SCHEMBL5091082 0.89 KHK (0.50) KHKHTR6HTR1ADRD2HTR2A
SCHEMBL5095012 0.87 THRB (0.38) KHKHTR6HTR1ADRD2HTR2A
SCHEMBL14100662 0.84 HTR6 (0.43) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL3335803 0.83 HTR6 (0.45) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL5097194 0.83 HTR6 (0.49) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL5097185 0.83 HTR6 (0.49) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL5091067 0.81 HTR6 (0.41) KHKHTR6HTR1ADRD2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200471-A1 6' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2008-08-21 US claimed
US-20080200471-A1 6' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2008-08-21 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-20080200471-A1 6' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY HTR6, HTR1B, HTR1A KHK 3564/4885HTR6 1/4885HTR1A 3/4885

“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.