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SCHEMBL9397295

SCHEMBL9397295

CC(C)C(NC(=O)C(Cc1ccc(F)cc1F)CC(O)C(Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NC(Cc1ccccc1)C(=O)NC(=O)N1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 6/20 0.46
▸ PSEN2 P49810 6/20 0.46
▸ APH1B Q8WW43 6/20 0.46
▸ NCSTN Q92542 6/20 0.46
▸ APH1A Q96BI3 6/20 0.46
▸ PSENEN Q9NZ42 6/20 0.46
▸ APP P05067 1/20 0.46
▸ BACE1 P56817 9/20 0.45
▸ REN P00797 2/20 0.42

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
SCHEMBL8893226 0.92 PSEN1 (0.51) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8893248 0.91 PSEN1 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1006593 0.91 PSEN1 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8892199 0.90 REN (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8908391 0.84 REN (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8892626 0.84 REN (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4180459 0.83 PSEN1 (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4180455 0.83 PSEN1 (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7435623 0.82 PSEN1 (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7442606 0.82 PSEN1 (0.40) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618222-A2 Dipeptid derivatives of 5-amino-4-hydroxy-hexanoic acid CIBA-GEIGY AG (CH) 1994-10-05 — — EP disclosed