SCHEMBL5963651

SCHEMBL5963651

CC1=C(c2cccc(Cl)c2)S(=O)(=O)N(C)C12CCCCC2

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GALR1 P47211 1/20 0.39
PGR P06401 3/20 0.38
HSD11B1 P28845 1/20 0.38
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 1/20 0.36
SLC6A2 P23975 5/20 0.35
SLC6A3 Q01959 5/20 0.35
SLC6A4 P31645 2/20 0.35
TP53 P04637 2/20 0.34
THRB P10828 1/20 0.34
BACE1 P56817 1/20 0.34

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 0.84 GRIN1 (0.36) NPC1RAB9AALDH1A1SLC6A2SLC6A3
SCHEMBL5964149 0.76 GALR1 (0.37) GALR1PGRHSD11B1NPC1RAB9A
SCHEMBL5963859 0.67 SLC6A2 (0.33) SLC6A2SLC6A3SLC6A4THRB
SCHEMBL3487270 0.66 CA12 (0.48) PGRALDH1A1TP53BACE1
SCHEMBL5963530 0.65 PGR (0.42) PGRNPC1RAB9AALDH1A1
SCHEMBL5963561 0.64 SLC6A2 (0.33) SLC6A2SLC6A3SLC6A4
SCHEMBL3487936 0.63 CA12 (0.45) PGRALDH1A1TP53
SCHEMBL817554 0.58 ALOX5 (0.65) PGRNPC1RAB9AALDH1A1TP53
SCHEMBL31222672 0.58 ALOX5 (0.65) PGRNPC1RAB9AALDH1A1TP53
SCHEMBL20340419 0.57 OPRM1 (0.60)

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 GALR1 404/4885PGR 813/4885HSD11B1 1622/4885

“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.