SCHEMBL5963662

SCHEMBL5963662

CC1=C(c2ccc(Cl)cc2)S(=O)(=O)N(C)C12CCCCC2

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 1/20 0.35
HSD11B1 P28845 5/20 0.35
GALR1 P47211 1/20 0.34
DRD2 P14416 2/20 0.33
DRD4 P21917 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC6A2 P23975 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
POLB P06746 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD11B2 P80365 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
SCHEMBL5964017 0.85 GRIN1 (0.36) DRD2HTTSLC6A2ALDH1A1SLC6A4
SCHEMBL5963651 0.84 GALR1 (0.39) HSD11B1GALR1SLC6A2ALDH1A1SLC6A4
SCHEMBL5963922 0.82 GALR1 (0.38) HSD11B1GALR1MEN1KMT2ASLC6A2
SCHEMBL5964149 0.78 GALR1 (0.37) HSD11B1GALR1L3MBTL1ALDH1A1
SCHEMBL5964213 0.77 HSD11B1 (0.33) HSD11B1DRD2DRD4L3MBTL1SLC6A2
SCHEMBL6820982 0.77 KDM4E (0.36) ADORA2BHSD11B1DRD2DRD4KDM4E
SCHEMBL5963530 0.76 PGR (0.42) MEN1KMT2AALDH1A1
SCHEMBL5964239 0.74 ELANE (0.34) HSD11B1KDM4EMEN1HTTKMT2A
SCHEMBL5963823 0.70 GALR1 (0.35) GALR1KDM4ESLC6A2ALDH1A1SLC6A4
SCHEMBL5963859 0.68 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3

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 2 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
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 ADORA2B 3395/4885HSD11B1 1622/4885GALR1 404/4885

“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.