Sugi Predict

Sugi Predict / Compounds / SCHEMBL8359164

SCHEMBL8359164

SCHEMBL8359164

O=C(NCCCN1CCCC1)OCC1CCc2ccccc2N1S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 16/20 1.00
▸ PSEN2 P49810 16/20 1.00
▸ APH1B Q8WW43 16/20 1.00
▸ NCSTN Q92542 16/20 1.00
▸ APH1A Q96BI3 16/20 1.00
▸ PSENEN Q9NZ42 16/20 1.00
▸ APP P05067 5/20 0.67

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
SCHEMBL8359153 0.94 PSEN1 (0.89) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8358695 0.89 PSEN1 (0.88) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8359150 0.89 PSEN1 (0.80) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8358697 0.88 PSEN1 (0.86) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8358699 0.88 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8358278 0.88 PSEN1 (0.78) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8358100 0.86 PSEN1 (0.76) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8358078 0.86 PSEN1 (0.77) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2152275 0.85 APP (0.86) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8358712 0.84 PSEN1 (1.00) 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
EP-1492765-B1 NOVEL GAMMA SECRETASE INHIBITORS SCHERING CORP (US) 2011-07-06 — — EP disclosed
WO-2003014075-A2 NOVEL GAMMA SECRETASE INHIBITORS SCHERING CORPORATION (US) 2003-02-20 — — WO disclosed