SCHEMBL5963964

SCHEMBL5963964

CCNCC1=C(c2ccccc2)S(=O)(=O)N(CC)C12CCCCC2

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
NLRP3 Q96P20 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CTSS P25774 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
OPRM1 P35372 2/20 0.31
OPRD1 P41143 2/20 0.31
OPRK1 P41145 2/20 0.31
OPRL1 P41146 2/20 0.31
RXFP1 Q9HBX9 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
SCHEMBL5963606 0.87 LMNA (0.32) LMNANLRP3L3MBTL1CTSLCTSB
SCHEMBL5001010 0.83 CACNA1G (0.38)
SCHEMBL5963859 0.80 SLC6A2 (0.33) LMNASLC6A2SLC6A4SLC6A3OPRM1
SCHEMBL5004854 0.78 HSD11B1 (0.32) LMNANLRP3L3MBTL1
SCHEMBL5900737 0.76 EBP (0.33) OPRM1OPRL1
SCHEMBL5964213 0.75 HSD11B1 (0.33) LMNANLRP3L3MBTL1SLC6A2SLC6A4
SCHEMBL5964134 0.74 LMNA (0.36) LMNANLRP3L3MBTL1SLC6A2SLC6A4
SCHEMBL5963556 0.73 KMT2A (0.34) LMNACTSLCTSBCTSSSLC6A2
SCHEMBL5963669 0.73 CHRNB2 (0.37) SLC6A2SLC6A4SLC6A3
SCHEMBL5963456 0.71 SLC6A2 (0.36) CTSLCTSBCTSSSLC6A2SLC6A4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1326851-B1 SUBSTITUTED DIPEPTIDES AS GROWTH HORMONE SECRETAGOGUES LILLY CO ELI (US) 2004-06-30 EP claimed
US-7125840-B2 Substituted dipeptides as growth hormone secretagogues ELI LILLY AND COMPANY (US) 2006-10-24 US disclosed
EP-1326851-B1 SUBSTITUTED DIPEPTIDES AS GROWTH HORMONE SECRETAGOGUES LILLY CO ELI (US) 2004-06-30 EP disclosed
US-20040058971-A1 Substituted dipeptides as growth hormone secretagogues ELI LILLY AND COMPANY 2004-03-25 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-20040058971-A1 Substituted dipeptides as growth hormone secretagogues GHSR, GHRHR, SSTR4 LMNA 4666/4885NLRP3 4236/4885L3MBTL1 2397/4885

“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.