SCHEMBL4950754

SCHEMBL4950754

CNC(=O)c1ccc(-c2ccc(-c3sccc3NS(=O)(=O)C(C)C)cc2)c(C#N)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.37
SCN9A Q15858 1/20 0.37
GRM5 P41594 2/20 0.37
ROCK2 O75116 5/20 0.35
ROCK1 Q13464 5/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
THRB P10828 1/20 0.35
RECQL P46063 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LRRK2 Q5S007 2/20 0.35
PTGS1 P23219 2/20 0.34
TNIK Q9UKE5 1/20 0.33
CHEK2 O96017 1/20 0.32
PTGS2 P35354 2/20 0.32

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
SCHEMBL5141284 0.91 SCN9A (0.47) SCN5ASCN9AGRM5ROCK2ROCK1
SCHEMBL4949007 0.90 GRM5 (0.36) SCN5ASCN9AGRM5ROCK2ROCK1
SCHEMBL4950102 0.89 PTGS1 (0.41) SCN5ASCN9AGRM5ROCK2ROCK1
SCHEMBL4953059 0.88 PTGS1 (0.37) KDM4EMEN1ALDH1A1LMNAKMT2A
SCHEMBL4949577 0.83 ALDH1A1 (0.42) MEN1ALDH1A1KMT2ASMN1; SMN2PTGS2
SCHEMBL4952472 0.82 F11 (0.35) SCN9AKDM4EPTGS1PTGS2
SCHEMBL4952527 0.82 PTGS2 (0.36) SCN9ALMNAPTGS1PTGS2
SCHEMBL4950027 0.77 TDP1 (0.39) KDM4EPTGS1PTGS2
SCHEMBL4950640 0.77 KDM4E (0.43) KDM4EPOLBPTGS1PTGS2
SCHEMBL4950116 0.77 PTGS1 (0.45) PTGS1CHEK2PTGS2

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 3 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
US-20070142441-A1 AMPA receptor potentiators ELI LILLY AND COMPANY 2007-06-21 US 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 SCN5A 666/4885SCN9A 466/4885GRM5 24/4885

“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.