SCHEMBL10122110

SCHEMBL10122110

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(-c2cn(C)c3cc(OC)ccc23)n[nH]1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.71
HTR6 P50406 5/20 0.36
HTR2A P28223 2/20 0.33
DRD2 P14416 2/20 0.33
APP P05067 2/20 0.32
USP2 O75604 2/20 0.32
TP53 P04637 2/20 0.32
CYP3A4 P08684 2/20 0.32
CASP1 P29466 2/20 0.32
CASP7 P55210 2/20 0.32
HBB P68871 2/20 0.32
HSD17B10 Q99714 2/20 0.32
NQO1 P15559 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
NPC1 O15118 1/20 0.32
PRNP P04156 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
ABCB1 P08183 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
SCHEMBL10121929 0.92 GHSR (0.70) GHSRHTR6HTR2ADRD2APP
SCHEMBL10121677 0.89 GHSR (0.71) GHSRHTR6HTR2ADRD2NQO1
SCHEMBL10121669 0.86 GHSR (0.61) GHSRTP53CASP7KDM4EALDH1A1
SCHEMBL1985177 0.85 GHSR (0.77) GHSRHTR6NQO1GSK3AGSK3B
SCHEMBL1990385 0.83 GHSR (1.00) GHSRUSP2TP53NPC1RAB9A
SCHEMBL10121949 0.83 GHSR (0.63) GHSRHTR6DRD2HTR1ADRD3
SCHEMBL10122112 0.83 GHSR (0.64) GHSRHTR6LMNASMN1; SMN2
SCHEMBL1709680 0.82 GHSR (0.61) GHSRMEN1KMT2A
SCHEMBL1709644 0.82 GHSR (0.62) GHSRSCN1ASCN2ASCN3AMEN1
SCHEMBL1709541 0.81 GHSR (0.61) GHSRHTR6SCN1ASCN2ASCN3A

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 1/4885HTR6 764/4885HTR2A 633/4885

“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.