SCHEMBL5963588

SCHEMBL5963588

CCNCC1=C(c2ccccc2Br)S(=O)(=O)NC12CCCCC2

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GALR1 P47211 1/20 0.32
PDE7A Q13946 2/20 0.31

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
SCHEMBL5964549 0.86 PDE7B (0.34) LMNAGALR1PDE7A
SCHEMBL5963697 0.84 SLC6A3 (0.34) LMNAALDH1A1GALR1
SCHEMBL5963556 0.83 KMT2A (0.34) LMNARAB9ASMN1; SMN2PDE7A
SCHEMBL5963816 0.81 OPRM1 (0.35) LMNAALDH1A1
SCHEMBL5963456 0.81 SLC6A2 (0.36) RAB9ASMN1; SMN2PDE7A
SCHEMBL5963362 0.80 GALR1 (0.34) ALDH1A1RAB9ASMN1; SMN2GALR1
SCHEMBL6823442 0.80 ALDH1A1 (0.32) LMNAALDH1A1RAB9ASMN1; SMN2GALR1
SCHEMBL5963604 0.79 POLB (0.35) ALDH1A1RAB9ASMN1; SMN2GALR1
SCHEMBL5963597 0.78 GALR1 (0.38) LMNAALDH1A1RAB9ASMN1; SMN2GALR1
SCHEMBL5963482 0.78 SLC6A2 (0.34) LMNAALDH1A1

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 4666/4885ALDH1A1 4282/4885RAB9A 4482/4885

“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.