SCHEMBL10121971

SCHEMBL10121971

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(COC(=O)N(C)C2CCCCC2)n(C)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.44
CCR5 P51681 8/20 0.37
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP3A4 P08684 2/20 0.33
CHRM2 P08172 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33
CHRM1 P11229 1/20 0.33
DRD1 P21728 1/20 0.33
SLC6A2 P23975 1/20 0.33
ADRA1A P35348 1/20 0.33
OPRM1 P35372 1/20 0.33
DRD3 P35462 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KCNH2 Q12809 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL10122225 0.99 GHSR (0.44) GHSRCCR5MEN1KMT2ACYP3A4
SCHEMBL10122084 0.93 GHSR (0.37) GHSRCCR5KMT2ACYP3A4CHRM2
SCHEMBL10121648 0.89 GHSR (0.43) GHSRCCR5HDAC1HDAC6L3MBTL1
SCHEMBL1709666 0.89 GHSR (0.43) GHSRCCR5MEN1KMT2AAGTR2
SCHEMBL1709738 0.88 GHSR (0.46) GHSRCCR5MEN1KMT2ATSHR
SCHEMBL1709564 0.88 GHSR (0.44) GHSRMEN1KMT2ACYP3A4CHRM2
SCHEMBL1709678 0.88 GHSR (0.43) GHSRCCR5MEN1KMT2ATSHR
SCHEMBL10121725 0.88 GHSR (0.49) GHSRMEN1KMT2ACHRM2HTR1A
SCHEMBL1709629 0.87 GHSR (0.45) GHSRCYP3A4CHRM2HTR1AADRA2A
SCHEMBL1709626 0.87 GHSR (0.45) GHSRCYP3A4CHRM2HTR1AADRA2A

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 1/4885CCR5 4058/4885MEN1 229/4885

“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.