SCHEMBL3621706

SCHEMBL3621706

O=S(=O)(c1ccccc1)n1ccc2c(CN3CCC3)cccc21

nearest known ligand 0.80

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.80
CYP3A4 P08684 2/20 0.80
CYP2D6 P10635 2/20 0.80
HTR1A P08908 2/20 0.63
HTR1D P28221 2/20 0.63
HTR1B P28222 2/20 0.63
HTR1F P30939 2/20 0.63
HTR7 P34969 2/20 0.63
DRD3 P35462 2/20 0.63
DRD2 P14416 1/20 0.59

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
SCHEMBL3624442 0.97 HTR6 (0.80) HTR6CYP3A4CYP2D6HTR1AHTR1D
Trifluoroacetic Acid SCHEMBL3617270 0.91 HTR6 (0.68) HTR6CYP3A4CYP2D6HTR1AHTR1D
SCHEMBL3620088 0.90 HTR6 (0.91) HTR6CYP3A4CYP2D6HTR1AHTR1D
SCHEMBL3201677 0.89 HTR6 (1.00) HTR6CYP3A4CYP2D6HTR1ADRD2
SCHEMBL16796479 0.89 HTR6 (0.75) HTR6CYP3A4CYP2D6HTR1AHTR1D
SCHEMBL3621546 0.89 HTR6 (1.00) HTR6CYP3A4CYP2D6HTR1AHTR1D
Hydrochloric Acid SCHEMBL3618986 0.89 HTR6 (0.92) HTR6CYP3A4CYP2D6HTR1AHTR1D
Trifluoroacetic Acid SCHEMBL3622703 0.89 HTR6 (0.68) HTR6CYP3A4CYP2D6HTR1AHTR1D
Hydrochloric Acid SCHEMBL3204600 0.88 HTR6 (1.00) HTR6CYP3A4CYP2D6HTR1AHTR1D
Hydrochloric Acid SCHEMBL3622792 0.88 HTR6 (1.00) HTR6CYP3A4CYP2D6HTR1AHTR1D

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 12 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 claimed
US-7812017-B2 4-substituted indole and indoline compounds BIOVITRUM AB (PUBL.) (SE) 2010-10-12 US claimed
CN-101484420-A Indoles as 5-HT 6 modulators BIOVITRUM AB PUBL (SE) 2009-07-15 CN claimed
US-20080032968-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-02-07 US claimed
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
US-7812017-B2 4-substituted indole and indoline compounds BIOVITRUM AB (PUBL.) (SE) 2010-10-12 US disclosed
US-7812017-B2 4-substituted indole and indoline compounds BIOVITRUM AB (PUBL.) (SE) 2010-10-12 US disclosed
CN-101484420-A Indoles as 5-HT 6 modulators BIOVITRUM AB PUBL (SE) 2009-07-15 CN disclosed
US-20080032968-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-02-07 US disclosed
US-20080032968-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-02-07 US disclosed
US-20080032968-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-02-07 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 (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 1/4885CYP3A4 405/4885CYP2D6 107/4885

“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.