SCHEMBL27809666

SCHEMBL27809666

CCOc1ccc(NC(=O)Nc2ccc(-c3ccnc(C)c3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 3/20 0.61
PSEN2 P49810 3/20 0.61
APH1B Q8WW43 3/20 0.61
NCSTN Q92542 3/20 0.61
APH1A Q96BI3 3/20 0.61
PSENEN Q9NZ42 3/20 0.61
PORCN Q9H237 2/20 0.61
MAPT P10636 9/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
POLB P06746 2/20 0.60
RAB9A P51151 9/20 0.57
NPC1 O15118 7/20 0.57
SMN1; SMN2 Q16637 6/20 0.57
GBA1 P04062 1/20 0.57
TP53 P04637 1/20 0.57
HSD17B10 Q99714 1/20 0.57
PKM P14618 3/20 0.56
KDM4E B2RXH2 2/20 0.55
WNT3A P56704 1/20 0.55

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
SCHEMBL1492766 0.89 PSEN1 (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1492931 0.83 KMT2A (0.65) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1493028 0.82 PSEN1 (0.68) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1492838 0.82 PORCN (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7968533 0.81 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1492873 0.80 PSEN1 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1492714 0.80 MAPT (0.57) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10576308 0.80 MAPT (0.86) MAPTMEN1KMT2APOLBRAB9A
SCHEMBL8197341 0.80 NAMPT (0.65) MAPTMEN1KMT2APOLBRAB9A
SCHEMBL1781477 0.79 PSEN1 (0.61) 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
CN-102083794-A Urea compounds as gamma secretase modulators AMGEN INC 2011-06-01 CN claimed