SCHEMBL3623213

SCHEMBL3623213

CN(C)Cc1cccc2c1ccn2S(=O)(=O)c1cccs1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 17/20 0.51
HTR1A P08908 2/20 0.51
HTR1D P28221 2/20 0.51
HTR1B P28222 2/20 0.51
HTR1F P30939 2/20 0.51
HTR7 P34969 2/20 0.51
DRD3 P35462 2/20 0.51
DRD2 P14416 1/20 0.51
CYP3A4 P08684 3/20 0.43
CYP2D6 P10635 2/20 0.43
HTT P42858 1/20 0.42
FABP4 P15090 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
Trifluoroacetic Acid SCHEMBL3620080 0.91 HTR6 (0.46) HTR6HTR1AHTR1DHTR1BHTR1F
SCHEMBL3623667 0.88 BCHE (0.46) HTR6HTR1AHTR1DHTR1BHTR1F
Trifluoroacetic Acid SCHEMBL3615386 0.80 BCHE (0.44) HTR6HTR1AHTR1DHTR1BHTR1F
SCHEMBL3622409 0.80 HTR6 (0.77) HTR6HTR1AHTR1DHTR1BHTR1F
SCHEMBL3620647 0.79 HTR6 (0.57) HTR6HTR1AHTR7CYP3A4CYP2D6
SCHEMBL3621074 0.79 HTR6 (0.57) HTR6HTR1AHTR7CYP3A4CYP2D6
SCHEMBL3621300 0.78 HTT (0.49) HTR6CYP3A4CYP2D6HTTFABP4
SCHEMBL3622721 0.77 HTR6 (0.61) HTR6HTR1AHTR7CYP3A4CYP2D6
SCHEMBL3617435 0.77 HTR6 (0.55) HTR6HTR1AHTR1DHTR1BHTR1F
SCHEMBL3622449 0.77 HTR6 (0.65) HTR6HTR1AHTR1DHTR1BHTR1F

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 14 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
EP-2046741-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (publ) (SE) 2009-04-15 EP claimed
US-20080032968-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-02-07 US claimed
WO-2008003703-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (PUBL) (SE) 2008-01-10 WO 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
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
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
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 3/4885HTR1D 11/4885

“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.