Muramyldipeptide

Muramyldipeptide

SCHEMBL20516502

CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1OC(C)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(N)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOD2 Q9HC29 1/20 1.00
▸ ESR1 P03372 2/20 0.68
▸ PGR P06401 2/20 0.68
▸ HTR1A P08908 1/20 0.68
▸ ADORA3 P0DMS8 1/20 0.68
▸ AR P10275 1/20 0.68
▸ CHRM1 P11229 1/20 0.68
▸ TBXA2R P21731 1/20 0.68
▸ PTGS1 P23219 1/20 0.68
▸ ADRA1A P35348 1/20 0.68
▸ KCNH2 Q12809 1/20 0.68
▸ MAPK1 P28482 1/20 0.60
▸ ALDH1A1 P00352 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ LGALS3 P17931 1/20 0.35
▸ SELP P16109 5/20 0.34
▸ SELL P14151 3/20 0.34
▸ SELE P16581 3/20 0.34
▸ ANPEP P15144 2/20 0.33
▸ PTPN1 P18031 1/20 0.33

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
Muramyldipeptide SCHEMBL20516503 1.00 NOD2 (1.00) NOD2ESR1PGRHTR1AADORA3
Muramyl Dipeptide SCHEMBL41813 1.00 NOD2 (1.00) NOD2ESR1PGRHTR1AADORA3
Muramyl Dipeptide SCHEMBL9770111 1.00 NOD2 (1.00) NOD2ESR1PGRHTR1AADORA3
Muramyldipeptide SCHEMBL15263102 1.00 NOD2 (1.00) NOD2ESR1PGRHTR1AADORA3
Muramyldipeptide SCHEMBL41814 1.00 NOD2 (1.00) NOD2ESR1PGRHTR1AADORA3
Muramyldipeptide SCHEMBL17299289 1.00 NOD2 (1.00) NOD2ESR1PGRHTR1AADORA3
Muramyldipeptide SCHEMBL19486934 1.00 NOD2 (1.00) NOD2ESR1PGRHTR1AADORA3
Muramyldipeptide SCHEMBL9231355 1.00 NOD2 (1.00) NOD2ESR1PGRHTR1AADORA3
Muramyl Dipeptide SCHEMBL769016 0.99 NOD2 (0.98) NOD2ESR1PGRHTR1AADORA3
SCHEMBL16802190 0.94 NOD2 (0.88) NOD2ESR1PGRHTR1AADORA3

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
US-20250170237-A1 MURAMYL DIPEPTIDES AND PROCESS FOR PREPARATION THEREOF UNIVERSITEIT GENT (BE) 2025-05-29 — — US disclosed
WO-2023161962-A1 MURAMYL DIPEPTIDES AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2023-08-31 — — WO disclosed
US-11413299-B2 Compositions and methods for treatment of inflammatory disorders THE JOHNS HOPKINS UNIVERSITY (US) 2022-08-16 — — US disclosed
US-20210128594-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INFLAMMATORY DISORDERS UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2021-05-06 — — US disclosed
US-10668092-B2 Compositions and methods for treatment of inflammatory disorders THE JOHN HOPKINS UNIVERSITY (US) 2020-06-02 — — US disclosed
US-20180280418-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INFLAMMATORY DISORDERS THE JOHNS HOPKINS UNIVERSITY 2018-10-04 — — 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 (5 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-20180280418-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INFLAMMATORY DISORDERS TLR4, TLR3, TLR2 NOD2 11/4885ESR1 1968/4885PGR 1666/4885
US-10668092-B2 Compositions and methods for treatment of inflammatory disorders TLR4, TLR3, TLR2 NOD2 11/4885ESR1 1968/4885PGR 1666/4885
US-11413299-B2 Compositions and methods for treatment of inflammatory disorders TLR4, TLR3, TLR2 NOD2 11/4885ESR1 1968/4885PGR 1666/4885
US-20210128594-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INFLAMMATORY DISORDERS TLR4, TLR3, TLR2 NOD2 11/4885ESR1 1968/4885PGR 1666/4885
US-20250170237-A1 MURAMYL DIPEPTIDES AND PROCESS FOR PREPARATION THEREOF NOD2, NOD1, TLR9 NOD2 1/4885ESR1 4554/4885PGR 4772/4885

“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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