SCHEMBL14036693

SCHEMBL14036693

CCOc1cc(C)c(CN(C)C(=O)Nc2ccc(-n3cnc(C)c3)c(F)c2)cc1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 12/20 0.39
PSEN2 P49810 12/20 0.39
APH1B Q8WW43 12/20 0.39
NCSTN Q92542 12/20 0.39
APH1A Q96BI3 12/20 0.39
PSENEN Q9NZ42 12/20 0.39
USP30 Q70CQ3 1/20 0.36
ALDH1A1 P00352 2/20 0.35
RET P07949 1/20 0.35
NPY2R P49146 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KCNH2 Q12809 2/20 0.34
GPR142 Q7Z601 1/20 0.34

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
SCHEMBL14036686 0.88 EP300 (0.38) ALDH1A1RETRAB9A
SCHEMBL14036808 0.81 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14036790 0.80 PSEN1 (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14036775 0.77 PSEN1 (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14036787 0.73 PSEN1 (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14036575 0.73 DDX3X (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14036794 0.72 PSEN1 (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759528 0.70 PSEN1 (0.60) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL757334 0.70 PSEN1 (0.45) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14036793 0.70 UBE2M (0.35) 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-2008137102-A2 METHODS OF MODULATING AMYLOID BETA AND COMPOUNDS USEFUL THEREFOR TORREYPINES THERAPEUTICS, INC. (US) 2008-11-13 WO disclosed