SCHEMBL7169709

SCHEMBL7169709

CC(Cc1ccc(Cl)c(Cl)c1)C(=O)NC1N=Cc2ccc(-c3ccc(F)cc3)cc2N(C)C1=O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 17/20 0.45
PSEN2 P49810 17/20 0.45
APH1B Q8WW43 17/20 0.45
NCSTN Q92542 17/20 0.45
APH1A Q96BI3 17/20 0.45
PSENEN Q9NZ42 17/20 0.45
SCN9A Q15858 1/20 0.37
CENPE Q02224 1/20 0.36
GSAP A4D1B5 1/20 0.35

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
SCHEMBL7194424 0.90 PSEN1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7186767 0.84 CCKBR (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7170270 0.81 PSEN1 (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7171304 0.80 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6005982 0.79 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7192961 0.79 NOTCH1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7166290 0.79 PSEN1 (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7163053 0.78 PSEN1 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7164400 0.78 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7166155 0.78 PSEN1 (0.46) 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-1294702-A1 BENZODIAZEPINE DERIVATIVES AS APP MODULATORS MERCK SHARP & DOHME LTD. (GB) 2003-03-26 EP disclosed
WO-2001090084-A1 BENZODIAZEPINE DERIVATIVES AS APP MODULATORS MERCK SHARP & DOHME LIMITED (GB) 2001-11-29 WO disclosed