SCHEMBL3569587

SCHEMBL3569587

CC(C)N(C)CCc1cccc2[nH]cc(S(=O)(=O)c3ccccc3)c12

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 18/20 0.80
SLC6A2 P23975 16/20 0.80
HTR2C P28335 3/20 0.59
HTR6 P50406 3/20 0.59
HTR2B P41595 2/20 0.39
HTR1A P08908 1/20 0.39
DRD1 P21728 1/20 0.39
HTR1D P28221 1/20 0.39
HTR1B P28222 1/20 0.39
HTR1E P28566 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
HTR7 P34969 1/20 0.39
DRD3 P35462 1/20 0.39
HTR5A P47898 1/20 0.39

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
SCHEMBL3566291 0.89 HTR2A (1.00) HTR2ASLC6A2HTR2CHTR6HTR2B
Hydrochloric Acid SCHEMBL3570714 0.88 HTR2A (0.98) HTR2ASLC6A2HTR2CHTR6HTR2B
SCHEMBL3566217 0.87 SLC6A2 (0.78) HTR2ASLC6A2HTR2CHTR6HTR1A
SCHEMBL3572919 0.86 HTR2A (1.00) HTR2ASLC6A2HTR2CHTR6HTR2B
SCHEMBL3571313 0.85 SLC6A2 (0.81) HTR2ASLC6A2HTR2CHTR6HTR1A
SCHEMBL3569544 0.82 SLC6A2 (1.00) HTR2ASLC6A2HTR2CHTR6HTR2B
SCHEMBL3571043 0.81 SLC6A2 (1.00) HTR2ASLC6A2HTR2CHTR6
SCHEMBL3574497 0.81 SLC6A2 (0.71) HTR2ASLC6A2HTR2CHTR6
SCHEMBL3566194 0.81 HTR2A (1.00) HTR2ASLC6A2HTR2CHTR6HTR1A
SCHEMBL3569288 0.80 SLC6A2 (0.76) HTR2ASLC6A2HTR2CHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7645752-B2 Sulfonyl substituted 1H-indoles as ligands for the 5-hydroxytryptamine receptors WYETH LLC (US) 2010-01-12 US claimed
EP-1973876-A2 SULFONYL SUBSTITUTED 1H-INDOLES AS LIGANDS FOR THE 5-HYDROXYTRYPTAMINE RECEPTORS Wyeth (US) 2008-10-01 EP claimed
US-20070203120-A1 Sulfonyl Substituted 1H-Indoles as Ligands for the 5-Hydroxytryptamine Receptors WYETH (US) 2007-08-30 US claimed
WO-2007084841-A2 SULFONYL SUBSTITUTED 1H-INDOLES AS LIGANDS FOR THE 5-HYDROXYTRYPTAMINE RECEPTORS WYETH (US) 2007-07-26 WO claimed
US-7645752-B2 Sulfonyl substituted 1H-indoles as ligands for the 5-hydroxytryptamine receptors WYETH LLC (US) 2010-01-12 US disclosed
EP-1973876-A2 SULFONYL SUBSTITUTED 1H-INDOLES AS LIGANDS FOR THE 5-HYDROXYTRYPTAMINE RECEPTORS Wyeth (US) 2008-10-01 EP disclosed
US-20070203120-A1 Sulfonyl Substituted 1H-Indoles as Ligands for the 5-Hydroxytryptamine Receptors WYETH (US) 2007-08-30 US disclosed
WO-2007084841-A2 SULFONYL SUBSTITUTED 1H-INDOLES AS LIGANDS FOR THE 5-HYDROXYTRYPTAMINE RECEPTORS WYETH (US) 2007-07-26 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-20070203120-A1 Sulfonyl Substituted 1H-Indoles as Ligands for the 5-Hydroxytryptamine Receptors HTR5A, HTR2C, HTR2A HTR2A 3/4885SLC6A2 20/4885HTR2C 2/4885

“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.