SCHEMBL3886874

SCHEMBL3886874

CN(C)CCc1cn(S(=O)(=O)c2cccc(F)c2)c2ncccc12

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.57
HTR7 P34969 3/20 0.57
HTR2A P28223 1/20 0.57
HTR2C P28335 1/20 0.57
HTR1A P08908 2/20 0.52
DRD2 P14416 2/20 0.52
HTR1D P28221 2/20 0.52
HTR1B P28222 2/20 0.52
HTR1F P30939 2/20 0.52
DRD3 P35462 2/20 0.52
HTR1E P28566 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
SCHEMBL3889814 0.88 HTR6 (0.51) HTR6HTR7HTR1ADRD2HTR1D
SCHEMBL3890007 0.87 HTR6 (0.57) HTR6HTR7HTR2AHTR2CHTR1A
SCHEMBL3888242 0.87 HTR6 (0.68) HTR6HTR7HTR1ADRD2HTR1D
SCHEMBL3887362 0.86 HTR6 (0.55) HTR6HTR7HTR2AHTR2C
SCHEMBL3889635 0.86 HTR6 (0.59) HTR6HTR7HTR1ADRD2HTR1D
SCHEMBL4007573 0.83 HTR6 (0.63) HTR6HTR7HTR1ADRD2HTR1D
SCHEMBL3893790 0.83 HTR6 (0.47) HTR6HTR7HTR2AHTR2CHTR1A
SCHEMBL3886588 0.82 HTR6 (0.59) HTR6HTR7HTR1ADRD2HTR1D
SCHEMBL3899518 0.82 HTR6 (0.56) HTR6HTR7HTR1ADRD2HTR1D
SCHEMBL3886182 0.81 HTR6 (0.72) HTR6HTR7HTR1ADRD2HTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7585876-B2 Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2009-09-08 US disclosed
EP-1456206-B1 AZAINDOLYLALKYLAMINE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH CORP (US) 2008-05-21 EP disclosed
US-20080114023-A1 AZAINDOLYLALKYLAMINE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2008-05-15 US disclosed
US-7297705-B2 Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2007-11-20 US disclosed
US-20050020598-A1 Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2005-01-27 US disclosed
US-6800640-B2 ANTISEROTONINE AGENTS; CENTRAL NERVOUS SYSTEM DISORDERS WYETH 2004-10-05 US disclosed
US-20030171395-A1 Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands WYETH 2003-09-11 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 (3 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-20030171395-A1 Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR1A HTR6 1/4885HTR7 6/4885HTR2A 4/4885
US-20050020598-A1 Azaindolylalkylamine derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR7 HTR6 1/4885HTR7 3/4885HTR2A 4/4885
US-20080114023-A1 AZAINDOLYLALKYLAMINE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS HTR6, HTR5A, HTR7 HTR6 1/4885HTR7 3/4885HTR2A 4/4885

“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.