SCHEMBL1709597

SCHEMBL1709597

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(CN(C)C(=O)NCC2CCCCC2)n[nH]1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.53
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MMP3 P08254 1/20 0.34
NAPEPLD Q6IQ20 7/20 0.34
REN P00797 1/20 0.34
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
GAA P10253 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
OPRK1 P41145 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
ACHE P22303 1/20 0.32
F10 P00742 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
SCHEMBL1709555 0.90 GHSR (0.54) GHSRALDH1A1LMNAMMP3
SCHEMBL1709669 0.89 GHSR (0.54) GHSRALDH1A1LMNARENGAA
SCHEMBL10121851 0.89 GHSR (0.56) GHSRALDH1A1LMNASMN1; SMN2MMP3
SCHEMBL1709563 0.88 GHSR (0.60) GHSRALDH1A1LMNAGAAACHE
SCHEMBL10122280 0.88 GHSR (0.54) GHSRALDH1A1LMNARENGAA
SCHEMBL10121891 0.87 GHSR (0.56) GHSRALDH1A1LMNARENGAA
SCHEMBL10122124 0.87 GHSR (0.54) GHSRALDH1A1LMNARENGAA
SCHEMBL10121989 0.87 GHSR (0.57) GHSRLMNAGAAOPRK1CNR2
SCHEMBL1709615 0.86 GHSR (0.61) GHSRALDH1A1LMNARENGAA
SCHEMBL10122116 0.86 GHSR (0.54) GHSRALDH1A1LMNAPPARGPPARA

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 1/4885ALDH1A1 3182/4885LMNA 3245/4885

“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.