SCHEMBL14950318

SCHEMBL14950318

CC(/C=C/c1ccccc1)=N\NC(=O)Oc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.69
MAPT P10636 9/20 0.57
ALDH1A1 P00352 3/20 0.57
GAA P10253 2/20 0.57
NPSR1 Q6W5P4 1/20 0.57
SMN1; SMN2 Q16637 6/20 0.56
KMT2A Q03164 6/20 0.56
MEN1 O00255 3/20 0.56
CCR6 P51684 1/20 0.53
HPGD P15428 1/20 0.51
PTBP1 P26599 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
LMNA P02545 1/20 0.51
FPR2 P25090 1/20 0.51

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
SCHEMBL9369768 0.82 MAPT (0.67) RAB9AMAPTALDH1A1GAANPSR1
SCHEMBL14938527 0.81 RAD51 (0.54) RAB9AMAPTALDH1A1SMN1; SMN2KMT2A
SCHEMBL30616243 0.75 ALDH1A1 (0.50) RAB9AMAPTALDH1A1GAASMN1; SMN2
SCHEMBL14938455 0.74 MAPT (0.64) RAB9AMAPTALDH1A1GAANPSR1
SCHEMBL942386 0.73 GAA (1.00) RAB9AMAPTALDH1A1GAANPSR1
SCHEMBL14938620 0.73 GAA (0.48) RAB9AMAPTALDH1A1GAASMN1; SMN2
SCHEMBL14938622 0.73 GAA (0.48) RAB9AMAPTALDH1A1GAASMN1; SMN2
Phenyl Cinnamate SCHEMBL1055160 0.72 KMT2A (0.77) RAB9AMAPTALDH1A1NPSR1SMN1; SMN2
Phenyl Cinnamate SCHEMBL1055161 0.72 KMT2A (0.77) RAB9AMAPTALDH1A1NPSR1SMN1; SMN2
SCHEMBL14938440 0.72 RAB9A (0.63) RAB9AMAPTALDH1A1GAASMN1; SMN2

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-2013067646-A1 PROCESS FOR THE SYNTHESIS OF BETA-AMINOCARBONYLS UNIVERSITY OF OTTAWA (CA) 2013-05-16 WO disclosed