SCHEMBL11036773

SCHEMBL11036773

O=C(O)CC[C@H](NCc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NAALAD2 Q9Y3Q0 3/20 0.67
▸ MME P08473 5/20 0.59
▸ ACE P12821 10/20 0.57
▸ FOLH1 Q04609 1/20 0.51
▸ CPA1 P15085 2/20 0.50
▸ ACE2 Q9BYF1 2/20 0.50

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
SCHEMBL11036772 0.86 NAALAD2 (0.57) NAALAD2MMEACEFOLH1
SCHEMBL29531430 0.84 NAALAD2 (0.62) NAALAD2MMEACE
SCHEMBL4356211 0.84 MME (0.58) MMEACECPA1ACE2
SCHEMBL6716497 0.84 MME (0.58) NAALAD2MMEACEFOLH1
SCHEMBL121370 0.84 MME (0.58) NAALAD2MMEACEFOLH1
SCHEMBL11346818 0.84 MME (0.58) NAALAD2MMEACEFOLH1
SCHEMBL121371 0.84 MME (0.58) NAALAD2MMEACEFOLH1
SCHEMBL6065430 0.84 MME (0.58) NAALAD2MMEACEFOLH1
SCHEMBL14433746 0.84 ECE1 (0.63) NAALAD2MMEACE
SCHEMBL13589992 0.84 ECE1 (0.63) NAALAD2MMEACE

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
JP-59130253-A — — None — — JP disclosed
JP-S59130253-A NOVEL GLUTAMIC ACID DERIVATIVE FUJISAWA PHARMACEUT CO LTD 1984-07-26 — — JP disclosed
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