SCHEMBL3622889

SCHEMBL3622889

COc1ccc2c(ccn2S(=O)(=O)c2ccccc2)c1CN(C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 16/20 0.57
HTR1A P08908 2/20 0.47
DRD2 P14416 2/20 0.47
HTR1D P28221 2/20 0.47
HTR1B P28222 2/20 0.47
HTR1F P30939 2/20 0.47
HTR7 P34969 2/20 0.47
DRD3 P35462 2/20 0.47
FABP4 P15090 2/20 0.45
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
HTR1E P28566 1/20 0.42

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
SCHEMBL3619807 0.89 HTR6 (0.62) HTR6HTR1ADRD2HTR1DHTR1B
Hydrochloric Acid SCHEMBL3623637 0.88 HTR6 (0.60) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3620641 0.82 HTR6 (0.54) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3621509 0.82 HTR6 (0.64) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3607517 0.81 HTR6 (0.63) HTR6DRD2DRD3POLBL3MBTL1
Trifluoroacetic Acid SCHEMBL3624798 0.80 HTR6 (0.47) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3619769 0.80 HTR6 (0.62) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3622891 0.80 HTR6 (0.56) HTR6FABP4POLBL3MBTL1PPARG
Trifluoroacetic Acid SCHEMBL3619591 0.79 HTR6 (0.55) HTR6HTR1AHTR1DHTR1BHTR1F
SCHEMBL3618838 0.79 HTR6 (0.51) HTR6HTR1ADRD2HTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046741-B1 INDOLES AS 5-HT6 MODULATORS PROXIMAGEN LTD (GB) 2012-10-31 EP disclosed
US-7812017-B2 4-substituted indole and indoline compounds BIOVITRUM AB (PUBL.) (SE) 2010-10-12 US disclosed
EP-2046741-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (publ) (SE) 2009-04-15 EP disclosed
US-20080032968-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-02-07 US disclosed
WO-2008003703-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (PUBL) (SE) 2008-01-10 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-20080032968-A1 New compounds HTR6, HTR1B, HTR1A HTR6 1/4885HTR1A 3/4885DRD2 41/4885

“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.