SCHEMBL1709741

SCHEMBL1709741

CCN(CC)CCCS(=O)(=O)N(Cc1ccccc1)Cc1nc(CN(C)C(=O)NC(C)C)n(C)n1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.35
ACHE P22303 2/20 0.35
PTGES O14684 5/20 0.35
ATM Q13315 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
MAOB P27338 1/20 0.32
GAA P10253 1/20 0.32
TACR2 P21452 2/20 0.31

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
SCHEMBL1709742 0.97 BCHE (0.35) BCHEACHEPTGESATMLMNA
SCHEMBL1709633 0.84 BCHE (0.36) BCHEACHEPTGESATMLMNA
SCHEMBL10122136 0.79 GHSR (0.39) BCHEACHEPTGESATMLMNA
SCHEMBL1709572 0.78 GHSR (0.46) BCHEACHEATMLMNAGAA
SCHEMBL10121858 0.77 GHSR (0.46) BCHEACHEPTGESLMNAGAA
SCHEMBL1709641 0.73 BCHE (0.36) BCHEACHEATM
SCHEMBL1709739 0.72 GHSR (0.45) BCHEACHELMNASMN1; SMN2GAA
SCHEMBL10121974 0.71 GHSR (0.46) BCHEACHEATMLMNAGAA
SCHEMBL10122141 0.71 GHSR (0.45) BCHEACHELMNAGAA
SCHEMBL10122251 0.69 GHSR (0.34) BCHEACHELMNAMAOBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088747-A1 SULFONAMIDE CONTAINING COMPOUNDS AND USES THEREOF ELIXIR PHARMACEUTICALS, INC. 2012-04-12 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-20120088747-A1 SULFONAMIDE CONTAINING COMPOUNDS AND USES THEREOF GHSR, GHRHR, STS BCHE 1675/4885ACHE 3696/4885PTGES 2229/4885

“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.