SCHEMBL4756884

SCHEMBL4756884

CCC(C)C(CC(=O)NC(Cc1c[nH]cn1)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)O)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(N)C(C)C

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 8/20 0.61
ANPEP P15144 3/20 0.61
AGTR1 P30556 1/20 0.53
AGTR2 P50052 1/20 0.53
SLC6A2 P23975 1/20 0.52
F2 P00734 4/20 0.52
NTSR2 O95665 1/20 0.51
NTSR1 P30989 1/20 0.51
REN P00797 1/20 0.50
OPRM1 P35372 1/20 0.49
OPRD1 P41143 1/20 0.49

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
Angiotensin Iv SCHEMBL4322224 0.92 LNPEP (0.68) LNPEPANPEPAGTR1AGTR2SLC6A2
Angiotensin Iv SCHEMBL4322236 0.92 LNPEP (0.68) LNPEPANPEPAGTR1AGTR2SLC6A2
SCHEMBL4756875 0.89 LNPEP (0.60) LNPEPANPEPAGTR1AGTR2SLC6A2
SCHEMBL4756901 0.89 LNPEP (0.61) LNPEPANPEPAGTR1AGTR2SLC6A2
SCHEMBL29619755 0.89 LNPEP (0.63) LNPEPANPEPAGTR1AGTR2SLC6A2
SCHEMBL9010597 0.88 LNPEP (0.64) LNPEPANPEPAGTR1AGTR2F2
SCHEMBL9010601 0.88 LNPEP (0.64) LNPEPANPEPAGTR1AGTR2F2
SCHEMBL31090172 0.88 SLC6A2 (0.64) LNPEPANPEPSLC6A2RENOPRM1
SCHEMBL29823327 0.87 DPP3 (0.60) LNPEPANPEPSLC6A2RENOPRM1
SCHEMBL29559228 0.87 LNPEP (0.55) LNPEPANPEPAGTR1AGTR2SLC6A2

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-20120115163-A1 MARKED PEPTIDES AND USE THEREOF FOR ASSAYING CIRCULATING IRAP VRIJE UNIVERSITEIT BRUSSEL (BE) 2012-05-10 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-20120115163-A1 MARKED PEPTIDES AND USE THEREOF FOR ASSAYING CIRCULATING IRAP IAPP, ANPEP, ENPEP LNPEP 12/4885ANPEP 2/4885AGTR1 1364/4885

“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.