SCHEMBL6853876

SCHEMBL6853876

COc1cc(C(=O)NC(c2ccccc2)c2ccc(Cl)cc2)ccc1-n1cnc(C)c1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 15/20 0.66
PSEN2 P49810 15/20 0.66
APH1B Q8WW43 15/20 0.66
NCSTN Q92542 15/20 0.66
APH1A Q96BI3 15/20 0.66
PSENEN Q9NZ42 15/20 0.66
RXFP1 Q9HBX9 1/20 0.52
ALDH1A1 P00352 1/20 0.51
KCNH2 Q12809 1/20 0.46
S1PR3 Q99500 2/20 0.44
S1PR1 P21453 1/20 0.44

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
SCHEMBL759708 0.83 PSEN1 (0.68) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759707 0.83 PSEN1 (0.68) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6854507 0.81 PSEN1 (0.82) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL761504 0.81 PSEN1 (0.71) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6855252 0.80 PSEN1 (0.71) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL757615 0.80 PSEN1 (0.72) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL761978 0.80 PSEN1 (0.85) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759484 0.79 PSEN1 (0.76) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6853605 0.78 PSEN1 (0.82) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759732 0.78 PSEN1 (0.66) 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-2011059048-A1 NOVEL AMIDE DERIVATIVE 大日本住友製薬株式会社 (JP) 2011-05-19 WO disclosed