SCHEMBL29777920

SCHEMBL29777920

CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 15/20 0.48
▸ NPY1R P25929 9/20 0.48
▸ NPY5R Q15761 8/20 0.48
▸ NPY2R P49146 5/20 0.48
▸ MC4R P32245 1/20 0.44
▸ BACE1 P56817 1/20 0.43
▸ GLP1R P43220 1/20 0.42
▸ SCTR P47872 1/20 0.42
▸ VIPR1 P32241 1/20 0.41
▸ VIPR2 P41587 1/20 0.41

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
SCHEMBL29808185 1.00 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RMC4R
SCHEMBL30512603 0.94 MC4R (0.47) NPY4RNPY1RNPY5RNPY2RMC4R
SCHEMBL30966840 0.92 NPY4R (0.54) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29808247 0.92 BACE1 (0.48) BACE1
SCHEMBL32682323 0.91 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2RBACE1
SCHEMBL29376654 0.89 NPY4R (0.50) NPY4RNPY1RNPY5RNPY2R
SCHEMBL31064805 0.89 NPY4R (0.50) NPY4RNPY1RNPY5RNPY2RMC4R
SCHEMBL31005077 0.88 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL9294926 0.88 NPY4R (0.50) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL30873807 0.88 NPY4R (0.61) NPY4RNPY1RNPY5RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114920798-A Self-assembly material constructed in situ at wound part and preparation method and application thereof 国家纳米科学中心 2022-08-19 — — CN claimed
US-20230295227-A1 COMPOUNDS FOR USE IN DIAGNOSIS AND/OR MONITORING OF FIBROSIS ANTAROS TRACER AB (SE) 2023-09-21 — — US disclosed
EP-4171663-A1 COMPOUNDS FOR USE IN DIAGNOSIS AND/OR MONITORING OF FIBROSIS Antaros Tracer AB (SE) 2023-05-03 — — EP disclosed
CN-115996761-A Compounds for diagnosing and/or monitoring fibrosis 安塔罗斯示踪剂公司 2023-04-21 — — CN disclosed
CN-114920798-A Self-assembly material constructed in situ at wound part and preparation method and application thereof 国家纳米科学中心 2022-08-19 — — CN disclosed
CN-114796123-A Self-assembled peptide nano preparation with anti-hepatic fibrosis function and preparation method and application thereof 安徽医科大学 2022-07-29 — — CN 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-20230295227-A1 COMPOUNDS FOR USE IN DIAGNOSIS AND/OR MONITORING OF FIBROSIS COL1A1, INHA, COL2A1 NPY4R 1439/4885NPY1R 460/4885NPY5R 1090/4885

“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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