SCHEMBL3576154

SCHEMBL3576154

O=S(=O)(c1ccccc1)c1c[nH]c2cccc(CCNCC3CCCO3)c12

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 16/20 0.65
HTR2A P28223 15/20 0.65
HTR2C P28335 1/20 0.55
HTR6 P50406 1/20 0.55
HPGD P15428 1/20 0.43
PKM P14618 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 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
SCHEMBL3569566 0.90 SLC6A2 (0.53) SLC6A2HTR2AHTR2CHTR6HPGD
SCHEMBL3566153 0.80 ALDH1A1 (0.42) SLC6A2HTR2AHPGDPKMKMT2A
SCHEMBL3575861 0.79 SLC6A2 (0.96) SLC6A2HTR2AHTR2CHTR6KMT2A
SCHEMBL3571269 0.79 SLC6A2 (1.00) SLC6A2HTR2AHTR2CHTR6KMT2A
SCHEMBL3577445 0.79 SLC6A2 (0.92) SLC6A2HTR2AHTR2CHTR6KMT2A
SCHEMBL3569760 0.78 SLC6A2 (0.79) SLC6A2HTR2AHTR2CHTR6KMT2A
SCHEMBL3565595 0.78 SLC6A2 (1.00) SLC6A2HTR2AHTR2CHTR6KMT2A
SCHEMBL3573953 0.78 SLC6A2 (0.98) SLC6A2HTR2AHTR2CHTR6KMT2A
SCHEMBL3569062 0.78 SLC6A2 (1.00) SLC6A2HTR2AHTR2CHTR6KMT2A
SCHEMBL3566194 0.77 HTR2A (1.00) SLC6A2HTR2AHTR2CHTR6ALDH1A1

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 SLC6A2 20/4885HTR2A 3/4885HTR2C 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.