SCHEMBL18636341

SCHEMBL18636341

Cc1noc(N2CC3CC[C@@H](C2)[C@@H]3Nc2nc3c(-c4ccc(OC(F)(F)F)cc4)cccn3n2)n1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 19/20 0.67
PSEN2 P49810 19/20 0.67
APH1B Q8WW43 19/20 0.67
NCSTN Q92542 19/20 0.67
APH1A Q96BI3 19/20 0.67
PSENEN Q9NZ42 19/20 0.67
KCNH2 Q12809 2/20 0.52
PI4KB Q9UBF8 5/20 0.50
JAK1 P23458 1/20 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
SCHEMBL18615039 1.00 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21886834 1.00 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18615041 1.00 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18636422 0.89 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18615139 0.89 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21887521 0.89 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18615138 0.89 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21886895 0.87 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21887048 0.84 PSEN1 (0.65) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18636240 0.84 PSEN1 (0.65) 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
WO-2017042114-A1 BRIDGED PIPERIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2017-03-16 WO disclosed