SCHEMBL10121985

SCHEMBL10121985

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

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.43
CCR5 P51681 8/20 0.40
F2 P00734 2/20 0.33
AGTR2 P50052 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.33
ATM Q13315 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 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
SCHEMBL1709666 0.92 GHSR (0.43) GHSRCCR5F2AGTR2L3MBTL1
SCHEMBL1709569 0.89 GHSR (0.48) GHSRGAAKMT2AMEN1
SCHEMBL10121719 0.88 GHSR (0.48) GHSRGAAKMT2AMEN1ALDH1A1
SCHEMBL1709728 0.88 GHSR (0.43) GHSRCCR5KMT2A
SCHEMBL1709580 0.86 GHSR (0.43) GHSRCCR5AGTR2KMT2AMEN1
SCHEMBL1709686 0.85 GHSR (0.45) GHSRL3MBTL1GAAKMT2AMEN1
SCHEMBL10122142 0.85 CCR5 (0.41) GHSRCCR5F2ATMKMT2A
SCHEMBL1709639 0.85 GHSR (0.45) GHSRL3MBTL1GAAKMT2AALDH1A1
SCHEMBL10122240 0.85 GHSR (0.46) GHSRGAAKMT2AMEN1ALDH1A1
SCHEMBL1709738 0.85 GHSR (0.46) GHSRCCR5F2AGTR2L3MBTL1

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 4058/4885F2 4516/4885

“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.