SCHEMBL5964549

SCHEMBL5964549

CCNCC1=C(c2ccccc2Cl)S(=O)(=O)NC12CCCCC2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE7B Q9NP56 2/20 0.34
HTR1A P08908 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
HTR5A P47898 1/20 0.33
HTR6 P50406 1/20 0.33
LMNA P02545 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
PDE7A Q13946 2/20 0.32
GALR1 P47211 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.31
GRIN2D O15399 1/20 0.30
GRIN3B O60391 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
SCHEMBL5963588 0.86 LMNA (0.33) LMNAPDE7AGALR1
SCHEMBL5963697 0.84 SLC6A3 (0.34) PDE7BHTR1BLMNASLC6A2SLC6A4
SCHEMBL5963556 0.83 KMT2A (0.34) PDE7BLMNASLC6A2SLC6A4SLC6A3
SCHEMBL5964210 0.81 AKR1B1 (0.34) PDE7BLMNASLC6A2SLC6A4SLC6A3
SCHEMBL5963456 0.81 SLC6A2 (0.36) PDE7BSLC6A2SLC6A4SLC6A3PDE7A
SCHEMBL5004858 0.80 AKR1B1 (0.33) PDE7BSLC6A2SLC6A4SLC6A3GALR1
SCHEMBL5963604 0.79 POLB (0.35) PDE7BGALR1KMT2A
SCHEMBL5963628 0.78 PDE7A (0.38) PDE7BLMNAPDE7AGALR1KMT2A
SCHEMBL5963482 0.78 SLC6A2 (0.34) PDE7BLMNASLC6A2SLC6A4SLC6A3
SCHEMBL5963816 0.77 OPRM1 (0.35) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PDE7B 1268/4885HTR1A 2216/4885HTR1D 2178/4885

“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.