SCHEMBL1709712

SCHEMBL1709712

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(Cc2cn(C)c3cc(F)ccc23)n[nH]1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.53
CCR4 P51679 2/20 0.32
PLK1 P53350 1/20 0.31
HTR6 P50406 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
ICMT O60725 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NR3C1 P04150 1/20 0.30

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
SCHEMBL1709622 0.92 GHSR (0.52) GHSRCCR4HTR6ICMTL3MBTL1
SCHEMBL1709543 0.91 GHSR (0.57) GHSRCCR4HTR6MEN1KMT2A
SCHEMBL1709653 0.87 GHSR (0.53) GHSRCCR4MEN1KMT2ATP53
SCHEMBL10121949 0.86 GHSR (0.63) GHSRHTR6
SCHEMBL1709599 0.85 GHSR (0.56) GHSRCCR4PLK1HTR6MEN1
SCHEMBL1994284 0.84 GHSR (0.62) GHSRCCR4TMEM97SIGMAR1MEN1
SCHEMBL1709601 0.83 GHSR (0.54) GHSRCCR4HTR6MEN1KMT2A
SCHEMBL10121930 0.81 GHSR (0.52) GHSRCCR4TP53
SCHEMBL10121951 0.80 GHSR (0.62) GHSRHTR6
SCHEMBL1994659 0.79 GHSR (0.58) GHSRCCR4HTR6KMT2ANR3C1

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 3489/4885PLK1 4654/4885

“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.