SCHEMBL1709643

SCHEMBL1709643

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(CNC(=O)c2cc(C)n(C)c2C)n[nH]1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.56
KLKB1 P03952 7/20 0.37
CNR2 P34972 2/20 0.34
CNR1 P21554 1/20 0.34
GAA P10253 1/20 0.33
MCL1 Q07820 1/20 0.33
APP P05067 3/20 0.33
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
HPGD P15428 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
SCHEMBL1709549 0.87 GHSR (0.65) GHSRGAASCN1ASCN2ASCN3A
SCHEMBL1709652 0.87 GHSR (0.57) GHSRGAAAPPSCN1ASCN2A
SCHEMBL10121984 0.86 GHSR (0.55) GHSRGAAMCL1SCN1ASCN2A
SCHEMBL10122103 0.85 GHSR (0.65) GHSRGAASCN1ASCN2ASCN3A
SCHEMBL10121676 0.85 GHSR (0.64) GHSRGAASCN1ASCN2ASCN3A
SCHEMBL10121682 0.85 GHSR (0.69) GHSRGAASCN1ASCN2ASCN3A
SCHEMBL10121950 0.85 GHSR (0.64) GHSRGAASCN1ASCN2ASCN3A
SCHEMBL1709605 0.84 GHSR (0.64) GHSRGAASCN1ASCN2ASCN3A
SCHEMBL1709677 0.84 GHSR (0.63) GHSRCNR2GAASCN1ASCN2A
SCHEMBL10121683 0.84 GHSR (0.63) GHSRGAASCN1ASCN2ASCN3A

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 1/4885KLKB1 2756/4885CNR2 141/4885

“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.