SCHEMBL6770905

SCHEMBL6770905

CC(C)C[C@H](N)C(=O)N(Cc1ccccc1)C1CCCNCC1=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 9/20 0.38
SLC6A2 P23975 4/20 0.37
SLC6A4 P31645 3/20 0.37
ANPEP P15144 1/20 0.36
RNPEP Q9H4A4 1/20 0.36
DNPEP Q9ULA0 1/20 0.36
CTSD P07339 1/20 0.35
GPR88 Q9GZN0 1/20 0.34
SLC6A3 Q01959 2/20 0.33
CYP2D6 P10635 1/20 0.33
KCNH2 Q12809 1/20 0.33
ATM Q13315 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
SCHEMBL5099589 0.82 OPRD1 (0.35) GHSRSLC6A2SLC6A4ANPEPRNPEP
SCHEMBL6764546 0.79 LMNA (0.34)
SCHEMBL4767101 0.79 CTSD (0.37) GHSRSLC6A2SLC6A4CTSDSLC6A3
SCHEMBL7430902 0.79 ALDH1A1 (0.38) GHSRSLC6A2SLC6A4CTSD
SCHEMBL4766714 0.78 GHSR (0.37) GHSRSLC6A2SLC6A4CTSDSLC6A3
SCHEMBL4936544 0.78 GHSR (0.37) GHSRSLC6A2SLC6A4CTSDSLC6A3
SCHEMBL6630511 0.77 GRN (0.48) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL5096405 0.74 CTSK (0.35)
SCHEMBL5096693 0.74 PSEN1 (0.33)
SCHEMBL7564716 0.73 PSEN1 (0.34) GHSRSLC6A2SLC6A4SLC6A3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040002487-A1 Protease inhibitors MARQUIS ROBERT WELLS (US) 2004-01-01 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-20040002487-A1 Protease inhibitors CTSK, MMP13, CTSZ GHSR 1254/4885SLC6A2 4474/4885SLC6A4 2533/4885

“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.