SCHEMBL1709681

SCHEMBL1709681

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(C2CN(C)c3ccccc3O2)n[nH]1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.56
NISCH Q9Y2I1 4/20 0.35
ACHE P22303 1/20 0.32
DUT P33316 1/20 0.31
CCR4 P51679 1/20 0.30
CYSLTR2 Q9NS75 1/20 0.30
CYSLTR1 Q9Y271 1/20 0.30

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
SCHEMBL1709618 0.89 GHSR (0.58) GHSRCYSLTR2CYSLTR1
SCHEMBL1709676 0.86 GHSR (0.56) GHSRNISCHCCR4
SCHEMBL1709668 0.82 GHSR (0.54) GHSR
SCHEMBL1989435 0.81 GHSR (0.62) GHSRDUTCCR4
SCHEMBL1709598 0.79 GHSR (0.58) GHSR
SCHEMBL1709621 0.77 GHSR (0.56) GHSRCCR4
SCHEMBL1709708 0.76 GHSR (0.67) GHSRCCR4
SCHEMBL10121926 0.76 GHSR (0.67) GHSRDUTCCR4
SCHEMBL10122113 0.76 GHSR (0.56) GHSRCCR4
SCHEMBL1991846 0.75 GHSR (0.71) GHSR

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 GHSR 1/4885NISCH 48/4885ACHE 3696/4885

“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.