SCHEMBL10122112

SCHEMBL10122112

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

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.64
CA12 O43570 6/20 0.38
CA1 P00915 6/20 0.38
CA9 Q16790 6/20 0.38
CA2 P00918 5/20 0.37
CCR4 P51679 1/20 0.34
PRKCA P17252 2/20 0.33
CACNA2D1 P54289 4/20 0.33
HTR6 P50406 1/20 0.32
DUT P33316 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 1/20 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
SCHEMBL1709680 0.93 GHSR (0.61) GHSRCA12CA1CA9CA2
SCHEMBL10121677 0.91 GHSR (0.71) GHSRCA12CA1CA9CA2
SCHEMBL1709644 0.91 GHSR (0.62) GHSRCA12CA1CA9CA2
SCHEMBL10121929 0.90 GHSR (0.70) GHSRCA12CA1CA9CA2
SCHEMBL1709541 0.89 GHSR (0.61) GHSRCCR4PRKCACACNA2D1HTR6
SCHEMBL1709599 0.86 GHSR (0.56) GHSRCA12CA1CA9CCR4
SCHEMBL10121669 0.83 GHSR (0.61) GHSRDUT
SCHEMBL1988787 0.83 GHSR (0.67) GHSRCCR4CACNA2D1HTR6
SCHEMBL10122110 0.83 GHSR (0.71) GHSRHTR6SMN1; SMN2LMNA
SCHEMBL1986948 0.83 GHSR (0.71) GHSRCCR4CACNA2D1LMNA

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.