SCHEMBL14423985

SCHEMBL14423985

CCCNC(=O)Nc1ccc(N(C)C)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.74
NPC1 O15118 5/20 0.74
RAB9A P51151 5/20 0.74
SMN1; SMN2 Q16637 5/20 0.74
GAA P10253 1/20 0.74
HDAC3 O15379 2/20 0.65
HDAC4 P56524 2/20 0.65
HDAC1 Q13547 2/20 0.65
HDAC7 Q8WUI4 2/20 0.65
HDAC2 Q92769 2/20 0.65
HDAC10 Q969S8 2/20 0.65
HDAC11 Q96DB2 2/20 0.65
HDAC8 Q9BY41 2/20 0.65
HDAC6 Q9UBN7 2/20 0.65
HDAC9 Q9UKV0 2/20 0.65
HDAC5 Q9UQL6 2/20 0.65
CNR1 P21554 3/20 0.63
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
NOX1 Q9Y5S8 3/20 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
SCHEMBL14424449 0.90 HDAC1 (0.70) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL16363832 0.86 NOX1 (0.63) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL29663991 0.82 RAB9A (0.76) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL10781905 0.81 MAPT (0.67) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL8803832 0.81 KMT2A (0.66) MAPTNPC1RAB9AGAAHDAC1
SCHEMBL14423994 0.81 KMT2A (0.66) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL10192175 0.81 MEN1 (0.66) MAPTNPC1RAB9ASMN1; SMN2CNR1
SCHEMBL14423986 0.81 MAPT (0.76) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL28800706 0.80 HDAC3 (0.57) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL23456385 0.79 KMT2A (0.64) MAPTNPC1RAB9ASMN1; SMN2GAA

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
EP-1829876-A1 NITROGENEOUS TRICYCLIC COMPOUND Asahi Kasei Pharma Corporation (JP) 2007-09-05 EP disclosed