SCHEMBL4950027

SCHEMBL4950027

CC(C)S(=O)(=O)Nc1cc(C(=O)O)ccc1-c1ccc(-c2sccc2NS(=O)(=O)C(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.39
PTGS1 P23219 3/20 0.39
GRIA4 P48058 1/20 0.39
KDM4E B2RXH2 1/20 0.37
PTGS2 P35354 6/20 0.36
NPSR1 Q6W5P4 1/20 0.34
SRD5A2 P31213 1/20 0.34
ACLY P53396 1/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL4950640 0.92 KDM4E (0.43) TDP1PTGS1GRIA4KDM4EPTGS2
SCHEMBL4950718 0.91 RARB (0.41) TDP1PTGS1GRIA4KDM4EPTGS2
SCHEMBL4950475 0.90 SRD5A2 (0.46) TDP1PTGS1GRIA4KDM4ESRD5A2
SCHEMBL4950116 0.90 PTGS1 (0.45) PTGS1PTGS2ALOX5APFEN1
SCHEMBL4945608 0.89 TDP1 (0.43) TDP1PTGS1KDM4EPTGS2NPSR1
SCHEMBL4953059 0.89 PTGS1 (0.37) PTGS1KDM4EPTGS2ALOX5APFEN1
SCHEMBL4953693 0.88 GRIA4 (0.49) PTGS1GRIA4KDM4EPTGS2SRD5A2
SCHEMBL4952509 0.87 TDP1 (0.37) TDP1PTGS1GRIA4KDM4EPTGS2
SCHEMBL4949007 0.87 GRM5 (0.36) TDP1PTGS1GRIA4KDM4E
SCHEMBL252191 0.86 TSHR (0.42) TDP1PTGS1GRIA4SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893597-B1 AMPA RECEPTOR POTENTIATORS LILLY CO ELI (US) 2008-11-12 EP disclosed
US-7393868-B2 AMPA receptor potentiators ELI LILLY AND COMPANY (US) 2008-07-01 US disclosed
EP-1893597-A2 AMPA RECEPTOR POTENTIATORS ELI LILLY AND COMPANY (US) 2008-03-05 EP disclosed
US-20070142441-A1 AMPA receptor potentiators ELI LILLY AND COMPANY 2007-06-21 US disclosed
WO-2006132811-A2 AMPA RECEPTOR POTENTIATORS ELI LILLY AND COMPANY (US) 2006-12-14 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 (1 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-20070142441-A1 AMPA receptor potentiators GABRE, GRIN1, GRIK2 TDP1 2634/4885PTGS1 1216/4885GRIA4 41/4885

“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.