SCHEMBL11092247

SCHEMBL11092247

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

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 5/20 0.62
▸ IL1RN P18510 4/20 0.58
▸ ERAP1 Q9NZ08 3/20 0.56
▸ LAP3 P28838 2/20 0.55
▸ ANPEP P15144 1/20 0.55
▸ RNPEP Q9H4A4 1/20 0.55
▸ DNPEP Q9ULA0 1/20 0.55
▸ BACE1 P56817 5/20 0.54
▸ BACE2 Q9Y5Z0 1/20 0.54
▸ NAALAD2 Q9Y3Q0 1/20 0.53
▸ MME P08473 1/20 0.53

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
SCHEMBL11092241 1.00 ERAP2 (0.62) ERAP2IL1RNERAP1LAP3ANPEP
SCHEMBL11095143 0.91 MME (0.63) ERAP2IL1RNERAP1LAP3ANPEP
SCHEMBL11090040 0.91 MME (0.63) ERAP2IL1RNERAP1LAP3ANPEP
SCHEMBL11095200 0.91 MME (0.63) ERAP2IL1RNERAP1LAP3ANPEP
SCHEMBL11090048 0.91 MME (0.63) ERAP2IL1RNERAP1LAP3ANPEP
SCHEMBL11412768 0.91 NAALAD2 (0.63) ERAP2LAP3ANPEPRNPEPDNPEP
SCHEMBL11412781 0.91 NAALAD2 (0.63) ERAP2LAP3ANPEPRNPEPDNPEP
Ubenimex SCHEMBL17889224 0.89 MME (0.66) LAP3ANPEPRNPEPDNPEPMME
Ubenimex SCHEMBL22632072 0.89 MME (0.66) LAP3ANPEPRNPEPDNPEPMME
Ubenimex SCHEMBL25971 0.89 MME (0.66) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4370318-A Bestatin-related compounds as immunopotentiator ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1983-01-25 — — US claimed
US-4473554-A Bestatin-related compounds as immunopotentiator ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1984-09-25 — — US disclosed
US-4370318-A Bestatin-related compounds as immunopotentiator ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1983-01-25 — — US disclosed
Send feedback