SCHEMBL6854645

SCHEMBL6854645

COc1cc(C(=O)NCc2cccc(Cl)c2F)ccc1-n1cnc(C)c1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 11/20 0.65
PSEN2 P49810 11/20 0.65
APH1B Q8WW43 11/20 0.65
NCSTN Q92542 11/20 0.65
APH1A Q96BI3 11/20 0.65
PSENEN Q9NZ42 11/20 0.65
ROCK2 O75116 5/20 0.49
ROCK1 Q13464 5/20 0.49
GPR142 Q7Z601 2/20 0.47
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL758302 0.88 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759095 0.86 PSEN1 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL758946 0.84 PSEN1 (0.74) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL758857 0.83 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL757740 0.83 PSEN1 (0.78) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL758826 0.83 PSEN1 (0.69) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL756360 0.82 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6853560 0.82 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759811 0.81 PSEN1 (0.71) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6852715 0.81 PSEN1 (0.71) 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