SCHEMBL7248481

SCHEMBL7248481

C[C@@H](C(=O)O)N(N[C@H]1C(=O)N(C(=O)OC(C)(C)C)c2ccccc2[C@@H]1c1ccccc1)C(=O)Cc1cc(F)cc(F)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 15/20 0.35
PSEN2 P49810 15/20 0.35
APH1B Q8WW43 15/20 0.35
NCSTN Q92542 15/20 0.35
APH1A Q96BI3 15/20 0.35
PSENEN Q9NZ42 15/20 0.35
GPR119 Q8TDV5 1/20 0.34
SCN9A Q15858 1/20 0.33
GSAP A4D1B5 1/20 0.32
TACR1 P25103 1/20 0.32

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
SCHEMBL4989424 0.81 PSEN1 (0.53) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5898316 0.68 BCHE (0.45) GPR119
SCHEMBL31499335 0.67 BCHE (0.42) GPR119SCN9A
SCHEMBL31499325 0.66 BCHE (0.40) GPR119
SCHEMBL18025768 0.65 BCHE (0.49) GPR119
SCHEMBL4985870 0.65 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4989336 0.65 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4994073 0.65 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL31499348 0.64 BCHE (0.40) GPR119
SCHEMBL7567891 0.64 PSEN1 (0.60) 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
US-6632811-B2 Administering cycloalkyl, lactam, lactone compounds for for inhibiting beta -amyloid peptide release and/or its synthesis in a cell ATHENA NEUROSCIENCES, INC. 2003-10-14 US disclosed