SCHEMBL626977

SCHEMBL626977

CCCN(CCC)[C@@H]1CCc2cc(CS(=O)(=O)c3ccc(OC)cc3)ccc2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 17/20 1.00
DRD2 P14416 16/20 1.00
DRD4 P21917 2/20 0.64

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
SCHEMBL29448456 1.00 DRD3 (1.00) DRD3DRD2DRD4
SCHEMBL10896624 0.83 DRD2 (1.00) DRD3DRD2DRD4
Hydrochloric Acid SCHEMBL10898263 0.82 DRD2 (0.97) DRD3DRD2DRD4
SCHEMBL10976331 0.79 DRD2 (1.00) DRD3DRD2DRD4
SCHEMBL7854627 0.78 DRD3 (0.67) DRD3DRD2
SCHEMBL7860144 0.78 DRD3 (0.66) DRD3DRD2DRD4
SCHEMBL9757621 0.76 DRD2 (0.83) DRD3DRD2DRD4
SCHEMBL7860284 0.76 DRD3 (0.63) DRD3DRD2
SCHEMBL11496079 0.75 DRD2 (0.82) DRD3DRD2DRD4
SCHEMBL7864930 0.74 DRD3 (0.61) DRD3DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220233475-A1 NOVEL D3 DOPAMINE RECEPTOR AGONISTS TO TREAT DYSKINESIA IN PARKINSON'S DISEASE UNIV DREXEL (US) 2022-07-28 US disclosed
US-11266612-B2 D3 dopamine receptor agonists to treat dyskinesia in Parkinson's disease DREXEL UNIVERSITY (US) 2022-03-08 US disclosed
US-20200390728-A1 NOVEL D3 DOPAMINE RECEPTOR AGONISTS TO TREAT DYSKINESIA IN PARKINSON'S DISEASE UNIV DREXEL (US) 2020-12-17 US disclosed
US-10543180-B2 D3 dopamine receptor agonists to treat dyskinesia in Parkinson's disease DREXEL UNIVERSITY (US) 2020-01-28 US disclosed
US-20170246128-A1 NOVEL D3 DOPAMINE RECEPTOR AGONISTS TO TREAT DYSKINESIA IN PARKINSON'S DISEASE UNIV DREXEL (US) 2017-08-31 US disclosed
US-9675565-B2 D3 dopamine receptor agonists to treat dyskinesia in parkinson's disease DREXEL UNIVERSITY (US) 2017-06-13 US disclosed
US-9289400-B2 D3 dopamine receptor agonists to treat dyskinesia in parkinson's disease DREXEL UNIVERSITY (US) 2016-03-22 US disclosed
EP-2439203-B1 Arylsulfonylmethyl or arylsulfonamide substituted aromatic compounds suitable for treating disorders that respond to modulation of the dopamine D3 receptor ABBVIE DEUTSCHLAND (DE) 2014-11-19 EP disclosed
US-20140228380-A1 Novel D3 Dopamine Receptor Agonists to Treat Dyskinesia in Parkinson's Disease UNIVERSITY OF MEDICINE AND DENTISTRY NEW JERSEY MEDICAL SCHOOL (US) 2014-08-14 US disclosed
US-20140228355-A1 Novel D3 Dopamine Receptor Agonists to Treat Dyskinesia in Parkinson's Disease UNIVERSITY OF MEDICINE AND DENTISTRY NEW JERSEY MEDICAL SCHOOL (US) 2014-08-14 US disclosed
EP-1812416-B1 ARYLSULFONYLMETHYL OR ARYLSULFONAMIDE SUBSTITUTED AROMATIC COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR ABBOTT GMBH & CO KG (DE) 2013-08-21 EP disclosed
EP-2603215-A2 NOVEL D3 DOPAMINE RECEPTOR AGONISTS TO TREAT DYSKINESIA IN PARKINSON'S DISEASE Philadelphia Health and Education Corporation (US) 2013-06-19 EP disclosed
WO-2012021629-A2 NOVEL D3 DOPAMINE RECEPTOR AGONISTS TO TREAT DYSKINESIA IN PARKINSON'S DISEASE PHILADELPHIA HEALTH & EDUCATION CORPORATION (US) 2012-02-16 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 (7 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-20200390728-A1 NOVEL D3 DOPAMINE RECEPTOR AGONISTS TO TREAT DYSKINESIA IN PARKINSON'S DISEASE DRD3, PARK7, SLC6A3 DRD3 1/4885DRD2 4/4885DRD4 15/4885
US-10543180-B2 D3 dopamine receptor agonists to treat dyskinesia in Parkinson's disease DRD3, PARK7, SLC6A3 DRD3 1/4885DRD2 4/4885DRD4 13/4885
US-11266612-B2 D3 dopamine receptor agonists to treat dyskinesia in Parkinson's disease DRD3, PARK7, SLC6A3 DRD3 1/4885DRD2 4/4885DRD4 13/4885
US-20220233475-A1 NOVEL D3 DOPAMINE RECEPTOR AGONISTS TO TREAT DYSKINESIA IN PARKINSON'S DISEASE DRD3, PARK7, SLC6A3 DRD3 1/4885DRD2 4/4885DRD4 15/4885
US-20140228380-A1 Novel D3 Dopamine Receptor Agonists to Treat Dyskinesia in Parkinson's Disease DRD3, PARK7, SLC6A3 DRD3 1/4885DRD2 4/4885DRD4 15/4885
US-20170246128-A1 NOVEL D3 DOPAMINE RECEPTOR AGONISTS TO TREAT DYSKINESIA IN PARKINSON'S DISEASE DRD3, PARK7, SLC6A3 DRD3 1/4885DRD2 4/4885DRD4 15/4885
US-20140228355-A1 Novel D3 Dopamine Receptor Agonists to Treat Dyskinesia in Parkinson's Disease DRD3, PARK7, SLC6A3 DRD3 1/4885DRD2 4/4885DRD4 15/4885

“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.