SCHEMBL20964477

SCHEMBL20964477

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

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.48
GHSR Q92847 2/20 0.48
OPRK1 P41145 1/20 0.47
SSTR3 P32745 1/20 0.46
MMP2 P08253 1/20 0.46
UTS2R Q9UKP6 1/20 0.45
EED O75530 1/20 0.44
KISS1R Q969F8 4/20 0.44

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
SCHEMBL24179809 0.91 GHSR (0.51) CTSLGHSROPRK1SSTR3MMP2
SCHEMBL20964474 0.88 MMP2 (0.50) CTSLGHSROPRK1SSTR3MMP2
SCHEMBL20964469 0.88 CTSL (0.49) CTSLGHSROPRK1MMP2UTS2R
SCHEMBL20964460 0.88 MMP2 (0.53) CTSLGHSROPRK1MMP2KISS1R
SCHEMBL24179837 0.88 PSMB5 (0.52) CTSLGHSRKISS1R
SCHEMBL20964424 0.84 GHSR (0.55) CTSLGHSR
SCHEMBL29389091 0.84 MMP2 (0.51) CTSLGHSROPRK1MMP2UTS2R
SCHEMBL20964476 0.83 QRFPR (0.49) CTSLGHSRKISS1R
SCHEMBL20964423 0.83 PRSS1 (0.61) CTSLGHSRKISS1R
SCHEMBL20964453 0.83 PTPN1 (0.57) CTSL

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-20190127419-A1 NEUROPEPTIDE S RECEPTOR (NPSR) AGONISTS RESEARCH TRIANGLE INSTITUTE 2019-05-02 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-20190127419-A1 NEUROPEPTIDE S RECEPTOR (NPSR) AGONISTS NPSR1, GRPR, NPBWR1 CTSL 318/4885GHSR 14/4885OPRK1 50/4885

“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.