SCHEMBL3623484

SCHEMBL3623484

CN1CCN(C)C(c2cccc3c2ccn3S(=O)(=O)c2ccccc2)C1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.61
DRD2 P14416 2/20 0.61
HTR1A P08908 1/20 0.61
HTR2A P28223 1/20 0.61
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
DRD3 P35462 1/20 0.49

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 SCHEMBL3620057 0.92 HTR6 (0.53) HTR6DRD2HTR1AHTR2ACYP3A4
Trifluoroacetic Acid SCHEMBL4021326 0.82 HTR6 (0.43) HTR6DRD2HTR1AHTR2ACYP3A4
SCHEMBL7949911 0.81 HTR6 (0.63) HTR6DRD2HTR1AHTR2ACYP3A4
SCHEMBL4675288 0.76 HTR6 (1.00) HTR6DRD2HTR1AHTR2ACYP3A4
SCHEMBL3201677 0.73 HTR6 (1.00) HTR6DRD2HTR1AHTR2ACYP3A4
SCHEMBL4680178 0.72 HTR6 (0.73) HTR6DRD2DRD3
SCHEMBL8685589 0.72 HTR6 (0.51) HTR6DRD2HTR1AHTR2ACYP3A4
SCHEMBL4310106 0.72 HTR6 (0.91) HTR6DRD2HTR1AHTR2ACYP3A4
SCHEMBL3623479 0.72 HTR6 (0.60) HTR6DRD2HTR1AHTR2ACYP3A4
SCHEMBL4049121 0.71 HTR6 (0.83) HTR6DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7812017-B2 4-substituted indole and indoline compounds BIOVITRUM AB (PUBL.) (SE) 2010-10-12 US 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
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 1/4885DRD2 41/4885HTR1A 3/4885

“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.