SCHEMBL16507827

SCHEMBL16507827

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 3/20 0.49
▸ PTPN1 P18031 2/20 0.45
▸ NPY4R P50391 2/20 0.45
▸ REN P00797 5/20 0.43
▸ MME P08473 1/20 0.42
▸ CPA1 P15085 1/20 0.42
▸ ACE2 Q9BYF1 1/20 0.42
▸ CASP1 P29466 1/20 0.41
▸ KISS1R Q969F8 2/20 0.41
▸ F2 P00734 1/20 0.40
▸ ANPEP P15144 1/20 0.40
▸ LNPEP Q9UIQ6 1/20 0.40

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
SCHEMBL31020877 0.93 ACE (0.47) ACENPY4RKISS1R
SCHEMBL16507899 0.92 PTPN1 (0.44) ACEPTPN1NPY4RREN
SCHEMBL13363654 0.90 ACE (0.49) ACENPY4RRENMMECPA1
SCHEMBL16507850 0.89 NPY4R (0.47) ACENPY4RRENKISS1RF2
SCHEMBL16358941 0.85 ACE (0.46) ACENPY4RMMECPA1ACE2
SCHEMBL16359347 0.85 ACE (0.46) ACENPY4RMMECPA1ACE2
SCHEMBL30670300 0.84 LNPEP (0.54) ACEMMECPA1ACE2ANPEP
SCHEMBL16507783 0.83 NPY4R (0.58) NPY4RKISS1R
SCHEMBL30277360 0.83 F2 (0.47) KISS1RF2
SCHEMBL16508079 0.83 NPY4R (0.57) NPY4RKISS1R

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-20110294738-A1 PTHR1 RECEPTOR COMPOUNDS ANTHOR THERAPEUTICS, INC. 2011-12-01 — — 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-20110294738-A1 PTHR1 RECEPTOR COMPOUNDS PTH1R, MC1R, CASR ACE 3206/4885PTPN1 826/4885NPY4R 1387/4885

“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.

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