SCHEMBL11089707

SCHEMBL11089707

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

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 2/20 0.61
PSEN2 P49810 2/20 0.61
APH1B Q8WW43 2/20 0.61
NCSTN Q92542 2/20 0.61
APH1A Q96BI3 2/20 0.61
PSENEN Q9NZ42 2/20 0.61
APP P05067 1/20 0.61
REN P00797 8/20 0.58
BACE1 P56817 8/20 0.54
PSMB1 P20618 1/20 0.52

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
SCHEMBL27041288 0.90 PSEN1 (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL23302438 0.90 PSEN1 (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL11095014 0.90 PSEN1 (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14725527 0.90 PSEN1 (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28525267 0.89 REN (0.59) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28525265 0.89 REN (0.59) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28525268 0.89 REN (0.59) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL22393402 0.88 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17278264 0.84 PSEN1 (0.59) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17899496 0.84 PSEN1 (0.63) PSEN1PSEN2APH1BNCSTNAPH1A

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-4473554-A Bestatin-related compounds as immunopotentiator ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1984-09-25 US disclosed
EP-0083931-A2 New bestatin-related compounds as immunopotentiator ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1983-07-20 EP disclosed