SCHEMBL1709680

SCHEMBL1709680

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(-c2cn(CCO)c3ccccc23)n[nH]1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.61
CA12 O43570 6/20 0.36
CA1 P00915 6/20 0.36
CA9 Q16790 6/20 0.36
CA2 P00918 5/20 0.36
PRKCA P17252 4/20 0.36
CCR4 P51679 1/20 0.33
HAT1 O14929 2/20 0.32
EP300 Q09472 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.32
PRKCB P05771 1/20 0.31
PRKCE Q02156 1/20 0.31
DUT P33316 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
SCHEMBL10122112 0.93 GHSR (0.64) GHSRCA12CA1CA9CA2
SCHEMBL1709644 0.89 GHSR (0.62) GHSRCA12CA1CA9CA2
SCHEMBL1709541 0.87 GHSR (0.61) GHSRPRKCACCR4MEN1KMT2A
SCHEMBL10121677 0.83 GHSR (0.71) GHSRCA12CA1CA9CA2
SCHEMBL10121929 0.83 GHSR (0.70) GHSRCA12CA1CA9CA2
SCHEMBL10121669 0.82 GHSR (0.61) GHSRKMT2ADUT
SCHEMBL10122110 0.82 GHSR (0.71) GHSRMEN1KMT2A
SCHEMBL1988787 0.81 GHSR (0.67) GHSRCCR4MEN1KMT2A
SCHEMBL1986948 0.80 GHSR (0.71) GHSRCCR4GAA
SCHEMBL1988279 0.80 GHSR (0.68) GHSRCCR4HAT1EP300MEN1

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 1/4885CA12 613/4885CA1 1399/4885

“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.