SCHEMBL5877944

SCHEMBL5877944

CC(CNS(=O)(=O)C(C)C)c1ccc(CC(O)c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 14/20 0.66
GRIA2 P42262 3/20 0.58
GRIA1 P42261 1/20 0.50
GRIA3 P42263 1/20 0.50
ADRB1 P08588 1/20 0.44
ADRB3 P13945 1/20 0.44
TAAR1 Q96RJ0 1/20 0.41
AOC3 Q16853 1/20 0.41
SMO Q99835 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
SCHEMBL338391 0.85 GRIA4 (0.81) GRIA4GRIA2GRIA1GRIA3TAAR1
SCHEMBL6554405 0.85 GRIA4 (0.81) GRIA4GRIA2GRIA1GRIA3TAAR1
SCHEMBL3704221 0.85 GRIA4 (0.81) GRIA4GRIA2GRIA1GRIA3TAAR1
SCHEMBL5877468 0.83 GRIA4 (0.63) GRIA4GRIA2GRIA1GRIA3
SCHEMBL6565117 0.81 GRIA4 (0.77) GRIA4GRIA2GRIA1GRIA3
SCHEMBL5878433 0.80 GRIA4 (1.00) GRIA4GRIA2GRIA1GRIA3
SCHEMBL5877786 0.79 GRIA4 (0.66) GRIA4GRIA2GRIA1GRIA3SMO
SCHEMBL5877493 0.78 GRIA4 (0.69) GRIA4GRIA2GRIA1GRIA3
SCHEMBL8583407 0.77 GRIA4 (0.65) GRIA4GRIA2GRIA1GRIA3
SCHEMBL5877501 0.76 GRIA4 (0.71) GRIA4GRIA2GRIA1GRIA3

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-7135487-B2 such as N-2-(4-Bromophenyl)propyl methanesulfonamide; sulfonamidation of the amine; glutamate receptor potentiators ELI LILLY AND COMPANY (US) 2006-11-14 US disclosed
US-20060030599-A1 SULPHONAMIDE DERIVATIVES ARNOLD MACKLIN B 2006-02-09 US disclosed
EP-1528055-A2 Sulphonamide Derivatives Eli Lilly & Company (US) 2005-05-04 EP disclosed
EP-0860428-B1 Sulphonamide derivatives LILLY CO ELI (US) 2004-12-08 EP disclosed
US-20040054009-A1 (BIS)sulfonamide derivatives KNOBELSDORF JAMES ALLEN (US) 2004-03-18 US disclosed
US-6596716-B2 2-propane-sulphonamide derivatives ELI LILLY AND COMPANY 2003-07-22 US disclosed
US-20020002158-A1 Sulphonamide derivatives ARNOLD MACKLIN B (US) 2002-01-03 US disclosed
US-6303816-B1 Sulphonamide derivatives ELI LILLY AND COMPANY 2001-10-16 US disclosed
WO-2000006537-A1 N-SUBSTITUTED SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2000-02-10 WO disclosed
EP-0860428-A2 Sulphonamide derivatives ELI LILLY AND COMPANY (US) 1998-08-26 EP 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 (3 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-20060030599-A1 SULPHONAMIDE DERIVATIVES GRIN2C, GLRA2, GLRA1 GRIA4 19/4885GRIA2 18/4885GRIA1 39/4885
US-20020002158-A1 Sulphonamide derivatives GRIN2C, GRM1, GRM3 GRIA4 20/4885GRIA2 27/4885GRIA1 17/4885
US-20040054009-A1 (BIS)sulfonamide derivatives GRIN2A, GRIN2B, GABRE GRIA4 14/4885GRIA2 9/4885GRIA1 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.