SCHEMBL5877872

SCHEMBL5877872

CC(CNS(=O)(=O)C(C)C)c1ccc(-c2ccc(CCNC(=O)c3ccc(F)cc3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 11/20 0.62
MCHR1 Q99705 2/20 0.56
MAPT P10636 1/20 0.53
GRIA2 P42262 3/20 0.53
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
GRIA1 P42261 1/20 0.48
GRIA3 P42263 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL5878181 0.89 GRIA4 (0.69) GRIA4MAPTGRIA2NPC1RAB9A
SCHEMBL5878045 0.88 GRIA4 (0.58) GRIA4MCHR1MAPTGRIA2GRIA1
SCHEMBL5877891 0.88 GRIA4 (0.60) GRIA4MAPTGRIA2NPC1RAB9A
SCHEMBL5877766 0.83 GRIA4 (0.72) GRIA4GRIA2RAB9AGRIA1GRIA3
SCHEMBL5878733 0.83 GRIA4 (0.71) GRIA4GRIA2GRIA1GRIA3MEN1
SCHEMBL5877621 0.82 GRIA4 (0.70) GRIA4GRIA2RAB9AGRIA1GRIA3
SCHEMBL5878575 0.81 GRIA4 (0.56) GRIA4MAPTGRIA2NPC1RAB9A
SCHEMBL5877913 0.81 GRIA4 (0.87) GRIA4GRIA2GRIA1GRIA3
SCHEMBL5877779 0.80 GRIA4 (0.58) GRIA4GRIA2GRIA1GRIA3
SCHEMBL5877949 0.80 GRIA4 (0.60) GRIA4MAPTGRIA2NPC1RAB9A

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-6525099-B1 Potentiating glutamate receptor function; psychiatric and neurological disorders ELI LILLY AND COMPANY 2003-02-25 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
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 19/4885MCHR1 335/4885MAPT 4760/4885
US-20020002158-A1 Sulphonamide derivatives GRIN2C, GRM1, GRM3 GRIA4 20/4885MCHR1 371/4885MAPT 4777/4885
US-20040054009-A1 (BIS)sulfonamide derivatives GRIN2A, GRIN2B, GABRE GRIA4 14/4885MCHR1 742/4885MAPT 1559/4885

“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.