SCHEMBL18133071

SCHEMBL18133071

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

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BMP1 P13497 3/20 0.48
▸ CASP1 P29466 4/20 0.40
▸ CASP3 P42574 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ CASP9 P55211 1/20 0.40
▸ GNPAT O15228 1/20 0.38
▸ ENPEP Q07075 6/20 0.37
▸ FOLH1 Q04609 1/20 0.37
▸ RIMKLA Q8IXN7 1/20 0.37
▸ NAALAD2 Q9Y3Q0 1/20 0.37
▸ TASP1 Q9H6P5 1/20 0.35
▸ ANPEP P15144 1/20 0.35

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
SCHEMBL16168238 0.89 CASP1 (0.40) CASP1CASP3GNPAT
SCHEMBL21732968 0.84 GNPAT (0.35) BMP1CASP1CASP3GNPAT
SCHEMBL16168241 0.81 MME (0.39) BMP1CASP1GNPATTASP1
SCHEMBL1674857 0.81 CASP1 (0.50) BMP1CASP1CASP3CASP7CASP9
SCHEMBL13194679 0.81 CASP1 (0.50) BMP1CASP1CASP3CASP7CASP9
SCHEMBL29310042 0.81 CASP1 (0.50) BMP1CASP1CASP3CASP7CASP9
SCHEMBL4100803 0.81 CASP1 (0.50) BMP1CASP1CASP3CASP7CASP9
SCHEMBL29946268 0.80 TASP1 (0.51) BMP1CASP1GNPATFOLH1TASP1
SCHEMBL13409194 0.79 ENPEP (0.47) BMP1ENPEPFOLH1RIMKLANAALAD2
SCHEMBL14035809 0.79 GNPAT (0.46) BMP1CASP1CASP3CASP7CASP9

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
EP-2709589-B1 CHARGE TRIGGERING OF SELF-ORGANIZED NANOPARTICLES UNIV DANMARKS TEKNISKE (DK) 2016-10-12 — — EP disclosed
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