SCHEMBL11412781

SCHEMBL11412781

N[C@H](Cc1ccccc1)[C@H](O)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NAALAD2 Q9Y3Q0 4/20 0.63
▸ LAP3 P28838 2/20 0.54
▸ ANPEP P15144 1/20 0.54
▸ RNPEP Q9H4A4 1/20 0.54
▸ DNPEP Q9ULA0 1/20 0.54
▸ FOLH1 Q04609 3/20 0.50
▸ POLB P06746 1/20 0.50
▸ ERAP2 Q6P179 1/20 0.49
▸ CPA3 P15088 1/20 0.49
▸ MME P08473 2/20 0.48
▸ ECE1 P42892 1/20 0.48
▸ GAA P10253 1/20 0.48

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
SCHEMBL11412768 1.00 NAALAD2 (0.63) NAALAD2LAP3ANPEPRNPEPDNPEP
SCHEMBL11414804 0.91 LAP3 (0.53) NAALAD2LAP3ANPEPRNPEPDNPEP
SCHEMBL11414794 0.91 LAP3 (0.53) NAALAD2LAP3ANPEPRNPEPDNPEP
SCHEMBL11092241 0.91 ERAP2 (0.62) NAALAD2LAP3ANPEPRNPEPDNPEP
SCHEMBL11092247 0.91 ERAP2 (0.62) NAALAD2LAP3ANPEPRNPEPDNPEP
SCHEMBL11414321 0.88 MME (0.61) LAP3ANPEPRNPEPDNPEPMME
SCHEMBL11414316 0.88 MME (0.61) LAP3ANPEPRNPEPDNPEPMME
SCHEMBL11415082 0.87 LAP3 (0.57) LAP3ANPEPRNPEPDNPEPMME
SCHEMBL5812584 0.87 LAP3 (0.57) LAP3ANPEPRNPEPDNPEPMME
SCHEMBL5812579 0.87 LAP3 (0.57) LAP3ANPEPRNPEPDNPEPMME

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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