SCHEMBL3662378

SCHEMBL3662378

Cc1cc(Br)cc(C(C)C(=O)N(c2ccc(-c3ccnc(C)c3)cc2)N(C(=O)C(C)c2cc(C)cc(N3CCN(c4ccccn4)CC3)c2)c2ccc(-c3ccnc(C)c3)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 12/20 0.45
PSEN2 P49810 12/20 0.45
APH1B Q8WW43 12/20 0.45
NCSTN Q92542 12/20 0.45
APH1A Q96BI3 12/20 0.45
PSENEN Q9NZ42 12/20 0.45
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HPGD P15428 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
SCHEMBL3662376 0.86 PSEN1 (0.63) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2185249 0.80 PSEN1 (0.69) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2183146 0.67 PSEN1 (0.85) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2182619 0.66 PSEN1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2184594 0.66 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2183624 0.65 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2185126 0.62 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30734172 0.60 ACHE (0.59) KDM4EALDH1A1HSD17B10MEN1KMT2A
SCHEMBL2185632 0.58 PSEN1 (0.71) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2184271 0.58 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2231602-A1 GAMMA SECRETASE MODULATORS Amgen, Inc (US) 2010-09-29 EP disclosed
WO-2009075874-A1 GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2009-06-18 WO disclosed