SCHEMBL10122241

SCHEMBL10122241

CCC(C)NC(=O)NCc1n[nH]c([C@@H](CCC2CCCCC2)NS(=O)(=O)CCCN(CC)CC)n1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.40
BMP1 P13497 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
EPHX1 P07099 1/20 0.31
MAPK14 Q16539 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
SCHEMBL1709628 0.95 GHSR (0.42) GHSRBMP1
SCHEMBL1709733 0.88 GHSR (0.42) GHSRBMP1
SCHEMBL1709705 0.85 GHSR (0.41) GHSRBMP1POLB
SCHEMBL10122244 0.85 GHSR (0.41) GHSRBMP1POLB
SCHEMBL1709655 0.83 GHSR (0.60) GHSRALDH1A1CYP2C19
SCHEMBL10122208 0.83 GHSR (0.44) GHSRBMP1
SCHEMBL10122207 0.82 GHSR (0.49) GHSRMEN1ALDH1A1KMT2A
SCHEMBL10121851 0.80 GHSR (0.56) GHSRALDH1A1EPHX1
SCHEMBL10121689 0.78 GHSR (0.61) GHSRALDH1A1CYP2C19
SCHEMBL1709717 0.77 GHSR (0.57) GHSRKMT2AEPHX1

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 1/4885BMP1 2622/4885MEN1 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.