SCHEMBL5365563

SCHEMBL5365563

CN1C=CC(c2c[nH]c3ccc(OS(=O)(=O)c4ccccc4)cc23)=CC1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.39
HTR1A P08908 4/20 0.38
DRD2 P14416 3/20 0.38
HTR2A P28223 1/20 0.37
HTR6 P50406 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
MAOB P27338 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
ALPL P05186 1/20 0.34
ALPI P09923 1/20 0.34

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
SCHEMBL5375294 0.78 SLC6A4 (0.67) SLC6A4HTR1AHTR6POLB
SCHEMBL5363988 0.78 GAA (0.37) HTR6ALDH1A1GAAMAOBSMN1; SMN2
SCHEMBL5363680 0.73 CYP1A2 (0.43) SLC6A4HTR1AHTR2AHTR6MAPT
SCHEMBL5369676 0.70 HTR6 (0.58) HTR1AHTR6MAPTHTR1DHTR1B
SCHEMBL5371257 0.66 SLC6A4 (0.63) SLC6A4HTR1AHTR6POLB
SCHEMBL9214509 0.65 HTR1D (0.43) HTR1AHTR2AALDH1A1MAPTGAA
SCHEMBL9214511 0.65 HTR1D (0.73) HTR1AHTR6ALDH1A1MAPTGAA
SCHEMBL6773787 0.63 PBRM1 (0.51) ALDH1A1MAPTMAOBSMN1; SMN2MEN1
SCHEMBL28390417 0.62 MEN1 (0.42) SLC6A4HTR1AALDH1A1MAPTMAOB
SCHEMBL1354825 0.61 TDP1 (0.50) ALDH1A1GAAMAOBSMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135484-A1 BENZENESULFONIC ACID INDOL-5-YL ESTERS AS ANTAGONISTS OF THE 5-HT6 RECEPTOR FILLA SANDRA A 2007-06-14 US disclosed
US-7230011-B2 Benzenesulfonic acid indol-5-yl esters as antagonists of the 5ht6 receptor ELI LILLY AND COMPANY (US) 2007-06-12 US disclosed
EP-1377580-B1 BENZENESULFONIC ACID INDOL-5-YL ESTERS AS ANTAGONISTS OF THE 5-HT6 RECEPTOR LILLY CO ELI (US) 2006-09-27 EP disclosed
US-20040102481-A1 Benzenesulfonic acid indol-5-yl esters as antagonists of the 5-ht6 receptor FILLA SANDRA ANN (US) 2004-05-27 US disclosed
EP-1377580-A2 BENZENESULFONIC ACID INDOL-5-YL ESTERS AS ANTAGONISTS OF THE 5-HT6 RECEPTOR ELI LILLY AND COMPANY (US) 2004-01-07 EP disclosed
WO-2002060871-A2 BENZENESULFONIC ACID INDOL-5-YL ESTERS AS ANTAGONISTS OF THE 5-HT6 RECEPTOR ELI LILLY AND COMPANY (US) 2002-08-08 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 (2 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-20040102481-A1 Benzenesulfonic acid indol-5-yl esters as antagonists of the 5-ht6 receptor HTR6, HTR5A, TPH1 SLC6A4 24/4885HTR1A 4/4885DRD2 157/4885
US-20070135484-A1 BENZENESULFONIC ACID INDOL-5-YL ESTERS AS ANTAGONISTS OF THE 5-HT6 RECEPTOR HTR6, HTR5A, HTR7 SLC6A4 23/4885HTR1A 6/4885DRD2 160/4885

“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.