SCHEMBL4949007

SCHEMBL4949007

CC(C)S(=O)(=O)Nc1ccsc1-c1ccc(-c2ccc(C(=O)O)cc2C#N)cc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.36
PTGS1 P23219 2/20 0.35
GRIA4 P48058 1/20 0.35
SCN5A Q14524 1/20 0.35
SCN9A Q15858 1/20 0.35
XDH P47989 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ROCK2 O75116 4/20 0.33
ROCK1 Q13464 4/20 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
SCHEMBL4952472 0.92 F11 (0.35) PTGS1GRIA4SCN9AXDHTDP1
SCHEMBL4950102 0.91 PTGS1 (0.41) GRM5PTGS1SCN5ASCN9AKDM4E
SCHEMBL4950754 0.90 SCN5A (0.37) GRM5PTGS1SCN5ASCN9AKDM4E
SCHEMBL5141284 0.89 SCN9A (0.47) GRM5SCN5ASCN9AROCK2ROCK1
SCHEMBL4950027 0.87 TDP1 (0.39) PTGS1GRIA4TDP1KDM4E
SCHEMBL4950640 0.86 KDM4E (0.43) PTGS1GRIA4TDP1KDM4E
SCHEMBL4950718 0.85 RARB (0.41) PTGS1GRIA4TDP1KDM4E
SCHEMBL4952527 0.85 PTGS2 (0.36) PTGS1SCN9AXDH
SCHEMBL4950475 0.85 SRD5A2 (0.46) PTGS1GRIA4TDP1KDM4E
SCHEMBL4950379 0.84 SCN9A (0.37) GRM5GRIA4SCN5ASCN9AXDH

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
EP-1893597-B1 AMPA RECEPTOR POTENTIATORS LILLY CO ELI (US) 2008-11-12 EP claimed
US-7393868-B2 AMPA receptor potentiators ELI LILLY AND COMPANY (US) 2008-07-01 US claimed
EP-1893597-A2 AMPA RECEPTOR POTENTIATORS ELI LILLY AND COMPANY (US) 2008-03-05 EP claimed
US-20070142441-A1 AMPA receptor potentiators ELI LILLY AND COMPANY 2007-06-21 US claimed
WO-2006132811-A2 AMPA RECEPTOR POTENTIATORS ELI LILLY AND COMPANY (US) 2006-12-14 WO claimed
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 GRM5 24/4885PTGS1 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.