SCHEMBL4670792

SCHEMBL4670792

CS(=O)(=O)n1cc(C2CCN(S(=O)(=O)Cl)CC2)c2cc(C#N)ccc21

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.37
HTR6 P50406 5/20 0.37
RORC P51449 5/20 0.37
IDO1 P14902 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
SLC6A4 P31645 2/20 0.36

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
SCHEMBL4674205 0.85 HTR6 (0.51) HTR1AHTR6SLC6A4
SCHEMBL4674201 0.84 HTR6 (0.38) HTR1AHTR6RORCIRAK4SLC6A4
SCHEMBL4671137 0.81 RORC (0.39) HTR6RORC
SCHEMBL4671138 0.81 RORC (0.39) HTR6RORC
SCHEMBL4673194 0.79 MMP2 (0.42) RORC
SCHEMBL4671109 0.76 SMN1; SMN2 (0.44) HTR6
SCHEMBL18324775 0.70 SLC6A4 (0.57) HTR1AHTR6SLC6A4
SCHEMBL4670879 0.70 HTR6 (0.45) HTR1AHTR6SLC6A4
SCHEMBL6636075 0.67 SLC6A4 (0.53) HTR1ARORCSLC6A4
SCHEMBL6133374 0.65 PDE5A (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0958287-B2 SULFAMIDE-METALLOPROTEASE INHIBITORS HOFFMANN LA ROCHE (CH) 2008-04-09 EP disclosed
EP-0958287-B1 SULFAMIDE-METALLOPROTEASE INHIBITORS HOFFMANN LA ROCHE (CH) 2002-09-11 EP disclosed
US-6376506-B1 REACTING SULFAMOYL OXAZOLIDONE WITH (1,2,3,4)-TETRAHYDRO-BETA-CARBOLINE TO FORM INHIBITOR; USED TO TREAT ARTHRITIS, OSTEOPOROSIS, PERIODONTAL DISEASE, CARDIOVASCULAR DISEASES, MULTIPLE SCLEROSIS, AND TUMORS SYNTEX (U.S.A.) LLC 2002-04-23 US disclosed
US-6143744-A Sulfamide-metalloprotease inhibitors SYNTEX (U.S.A.) INC. (US) 2000-11-07 US disclosed
US-6130220-A ENZYME INHIBITORS SYNTEX (USA) INC. (US) 2000-10-10 US disclosed
US-5998412-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS SYNTEX (U.S.A.) INC. (US) 1999-12-07 US disclosed