SCHEMBL10778212

SCHEMBL10778212

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

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 4/20 0.59
▸ FOLH1 Q04609 2/20 0.48
▸ SLC6A5 Q9Y345 1/20 0.47
▸ FURIN P09958 7/20 0.43
▸ ESR1 P03372 1/20 0.43
▸ PGR P06401 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.43
▸ AR P10275 1/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ TBXA2R P21731 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ NMT2 O60551 1/20 0.42
▸ NMT1 P30419 1/20 0.42
▸ TLR2 O60603 1/20 0.42
▸ SIRT5 Q9NXA8 1/20 0.42
▸ GNPAT O15228 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
SCHEMBL10864620 0.85 NOD1 (0.53) NOD1FOLH1SLC6A5ESR1PGR
SCHEMBL29430995 0.83 NOD1 (0.51) NOD1SLC6A5ESR1PGRHTR1A
SCHEMBL6129561 0.83 NOD1 (0.61) NOD1FOLH1SLC6A5FURINNMT2
SCHEMBL2508780 0.83 NOD1 (0.61) NOD1FOLH1SLC6A5FURINNMT2
SCHEMBL21330513 0.81 NOD1 (0.68) NOD1FOLH1SLC6A5NMT2NMT1
SCHEMBL19529151 0.81 NOD1 (0.68) NOD1FOLH1SLC6A5NMT2NMT1
SCHEMBL29398096 0.81 GNPAT (0.53) FOLH1FURINGNPAT
SCHEMBL22607329 0.81 SIRT5 (0.54) NOD1FOLH1ESR1PGRHTR1A
SCHEMBL29527293 0.80 NOD1 (0.58) NOD1FOLH1SLC6A5FURINNMT2
SCHEMBL1573989 0.80 NOD1 (0.58) NOD1FOLH1SLC6A5FURINNMT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0149581-B1 COMPOSITIONS CONTAINING OLIGO-MURAMYLPEPTIDES AND THEIR APPLICATION, IN PARTICULAR FOR THE ACTIVATION OF MACROPHAGES ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1987-07-22 — — EP disclosed
EP-0149581-A2 Compositions containing oligo-muramylpeptides and their application, in particular for the activation of macrophages ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1985-07-24 — — EP disclosed
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