SCHEMBL337413

SCHEMBL337413

CN(C)CCn1ccc2c(N)cccc21

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.68
HTR2A P28223 4/20 0.57
HTR6 P50406 10/20 0.48
HTR1D P28221 2/20 0.43
CNR2 P34972 1/20 0.40

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
SCHEMBL847974 0.81 HTR2C (0.68) HTR2CHTR2AHTR6HTR1DCNR2
SCHEMBL23956102 0.81 HTR2C (0.68) HTR2CHTR2AHTR6HTR1DCNR2
SCHEMBL1990730 0.81 HTR2C (0.44) HTR2CHTR2AHTR6
SCHEMBL3747700 0.80 PARP1 (0.62) HTR2CHTR2AHTR6
SCHEMBL23927902 0.78 HTR2C (0.64) HTR2CHTR2AHTR6HTR1D
SCHEMBL913801 0.78 MPO (0.44) HTR2CHTR2AHTR6
SCHEMBL30672847 0.77 HTR2C (0.42) HTR2CHTR2ACNR2
SCHEMBL14909548 0.77 HTR2C (0.42) HTR2CHTR2ACNR2
SCHEMBL4329685 0.77 HTR2C (0.62) HTR2CHTR2AHTR6HTR1D
SCHEMBL15999003 0.76 HTR2C (0.65) HTR2CHTR2AHTR6HTR1DCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120128768-A1 ACTIVE SUBSTANCE COMBINATION COMPRISING A COMPOUND WITH NPY RECEPTOR AFFINITY AND A COMPOUND WITH 5-HT6 RECEPTOR AFFINITY LABORATORIOS DEL DR. ESTEVE S.A (ES) 2012-05-24 US disclosed
US-8097643-B2 Indol-4 sulfonamide derivatives, their preparation and their use 5-ht-6 as modulators LABORATORIOS DEL DR. ESTEVE S. A. (ES) 2012-01-17 US disclosed
CN-100518736-C Indol-4 sulfonamide derivatives, their preparation and their use 5-ht-6 as modulators ESTEVE LABOR DR (ES) 2009-07-29 CN disclosed
EP-1660131-B1 ACTIVE SUBSTANCE COMBINATION COMPRISING A COMPOUND WITH NPY RECEPTOR AFFINITY AND A COMPOUND WITH 5-HT6 RECEPTOR AFFINITY ESTEVE LABOR DR (ES) 2009-06-24 EP disclosed
EP-1648446-B1 INDOL-4 SULFONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE 5-HT-6 AS MODULATORS ESTEVE LABOR DR (ES) 2009-06-03 EP disclosed
EP-1648468-B1 ACTIVE SUBSTANCE COMBINATION COMPRISING A COMPOUND WITH NPY RECEPTOR AFFINITY AND A COMPOUND WITH 5-HT6 RECEPTOR AFFINITY ESTEVE LABOR DR (ES) 2008-09-24 EP disclosed
US-20070185158-A1 Indol-4 sulfonamide derivatives, their preparation and their use 5-ht-6 as modulators LABORATORIOS DEL DR. ESTEVE S.A (ES) 2007-08-09 US disclosed
US-20070059364-A1 Active substance combination comprising a compound with npy receptor affinity and a compound with 5-ht6 receptor affinity LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2007-03-15 US disclosed
US-20070009597-A1 Active substance combination comprising a compound with npy receptor affinity and a compound with 5-ht6 receptor affinity LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2007-01-11 US disclosed
CN-1829508-A Indole-4 sulfonamide derivatives, their preparation and their use as 5-HT-6 modulators ESTEVE LABOR DR (ES) 2006-09-06 CN 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 (4 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-20070059364-A1 Active substance combination comprising a compound with npy receptor affinity and a compound with 5-ht6 receptor affinity HTR6, NPY5R, NPY2R HTR2C 23/4885HTR2A 18/4885HTR6 1/4885
US-20070185158-A1 Indol-4 sulfonamide derivatives, their preparation and their use 5-ht-6 as modulators HTR6, SLC6A4, HTR4 HTR2C 9/4885HTR2A 18/4885HTR6 1/4885
US-20120128768-A1 ACTIVE SUBSTANCE COMBINATION COMPRISING A COMPOUND WITH NPY RECEPTOR AFFINITY AND A COMPOUND WITH 5-HT6 RECEPTOR AFFINITY HTR6, NPY5R, NPY2R HTR2C 23/4885HTR2A 18/4885HTR6 1/4885
US-20070009597-A1 Active substance combination comprising a compound with npy receptor affinity and a compound with 5-ht6 receptor affinity NPY5R, HTR6, NPY2R HTR2C 32/4885HTR2A 19/4885HTR6 2/4885

“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.