SCHEMBL1709599

SCHEMBL1709599

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(Cc2cn(CC)c3ccccc23)n[nH]1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.56
CCR4 P51679 2/20 0.35
HTR6 P50406 5/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA9 Q16790 1/20 0.32
PLK1 P53350 1/20 0.32
CACNA2D1 P54289 4/20 0.32
PRKCA P17252 1/20 0.32
CYP19A1 P11511 1/20 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
SCHEMBL1709543 0.92 GHSR (0.57) GHSRCCR4HTR6MEN1KMT2A
SCHEMBL10121930 0.91 GHSR (0.52) GHSRCCR4
SCHEMBL1709622 0.91 GHSR (0.52) GHSRCCR4HTR6
SCHEMBL10121951 0.90 GHSR (0.62) GHSRHTR6
SCHEMBL1709601 0.89 GHSR (0.54) GHSRCCR4HTR6MEN1KMT2A
SCHEMBL10122112 0.86 GHSR (0.64) GHSRCCR4HTR6CA12CA1
SCHEMBL1709712 0.85 GHSR (0.53) GHSRCCR4HTR6MEN1KMT2A
SCHEMBL1994659 0.84 GHSR (0.58) GHSRCCR4HTR6KMT2ACYP19A1
SCHEMBL1709653 0.83 GHSR (0.53) GHSRCCR4MEN1KMT2A
SCHEMBL10121922 0.83 GHSR (0.58) GHSRCCR4CA12CA1CA9

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 1/4885CCR4 3489/4885HTR6 764/4885

“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.