SCHEMBL11414794

SCHEMBL11414794

NC(=O)CC[C@H](NC(=O)C(O)C(N)Cc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LAP3 P28838 2/20 0.53
▸ ANPEP P15144 1/20 0.53
▸ RNPEP Q9H4A4 1/20 0.53
▸ DNPEP Q9ULA0 1/20 0.53
▸ NAALAD2 Q9Y3Q0 2/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ MME P08473 2/20 0.51
▸ ECE1 P42892 1/20 0.51
▸ GNPAT O15228 1/20 0.46
▸ MMP2 P08253 2/20 0.44
▸ MMP9 P14780 2/20 0.44
▸ SLC15A1 P46059 1/20 0.44

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
SCHEMBL11414804 1.00 LAP3 (0.53) LAP3ANPEPRNPEPDNPEPNAALAD2
SCHEMBL11412768 0.91 NAALAD2 (0.63) LAP3ANPEPRNPEPDNPEPNAALAD2
SCHEMBL11412781 0.91 NAALAD2 (0.63) LAP3ANPEPRNPEPDNPEPNAALAD2
SCHEMBL11414321 0.86 MME (0.61) LAP3ANPEPRNPEPDNPEPMME
SCHEMBL11414316 0.86 MME (0.61) LAP3ANPEPRNPEPDNPEPMME
SCHEMBL5812584 0.86 LAP3 (0.57) LAP3ANPEPRNPEPDNPEPMME
SCHEMBL11415082 0.86 LAP3 (0.57) LAP3ANPEPRNPEPDNPEPMME
SCHEMBL5812579 0.86 LAP3 (0.57) LAP3ANPEPRNPEPDNPEPMME
SCHEMBL5970501 0.85 NAALAD2 (0.55) NAALAD2KMT2AMMEECE1GNPAT
SCHEMBL31672244 0.85 NAALAD2 (0.55) NAALAD2KMT2AMMEECE1GNPAT

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
US-4240975-A USED AS ENZYME INHIBITOR, ANTIFERTILITY AGENT, AND ENHANCES THE ANTITUMOR EFFECT OF BLEOMYCIN ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1980-12-23 — — US disclosed
US-4189604-A PEPTIDASE ENZYME INHIBITORS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1980-02-19 — — US disclosed
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