SCHEMBL3976332

SCHEMBL3976332

CCOC(=O)c1ccc(NC(=S)NC2CC2)cc1

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.90
KMT2A Q03164 7/20 0.72
MEN1 O00255 6/20 0.72
ALDH1A1 P00352 5/20 0.72
NPSR1 Q6W5P4 2/20 0.72
SMN1; SMN2 Q16637 3/20 0.67
GAA P10253 3/20 0.67
KDM4E B2RXH2 1/20 0.67
POLB P06746 1/20 0.66
CYP1A2 P05177 1/20 0.66
CYP2D6 P10635 1/20 0.66
CYP2C9 P11712 1/20 0.66
CYP2C19 P33261 1/20 0.66
RAB9A P51151 2/20 0.63
NPC1 O15118 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.60
TDP1 Q9NUW8 1/20 0.59
LMNA P02545 1/20 0.59
ABL1 P00519 1/20 0.58
HTT P42858 1/20 0.58

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
SCHEMBL346651 0.81 MAPT (0.73) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL28464045 0.80 ALDH1A1 (1.00) MAPTKMT2AMEN1ALDH1A1NPSR1
SCHEMBL1542810 0.80 RAB9A (0.64) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
Methyl Alcohol SCHEMBL27776732 0.79 ALDH1A1 (0.97) MAPTKMT2AMEN1ALDH1A1NPSR1
SCHEMBL7066252 0.79 ALDH1A1 (0.72) MAPTKMT2AMEN1ALDH1A1NPSR1
SCHEMBL10977555 0.78 SMN1; SMN2 (0.70) MAPTKMT2AMEN1ALDH1A1NPSR1
SCHEMBL10977586 0.78 SMN1; SMN2 (0.70) MAPTKMT2AMEN1ALDH1A1NPSR1
SCHEMBL10703240 0.77 MAPT (0.67) MAPTKMT2AMEN1ALDH1A1NPSR1
SCHEMBL25228303 0.77 RAB9A (1.00) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL14386135 0.77 MEN1 (0.81) MAPTKMT2AMEN1ALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009053448-A1 COMPOUNDS WHICH POTENTIATE AMPA RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2009-04-30 WO disclosed
WO-2009053448-A1 COMPOUNDS WHICH POTENTIATE AMPA RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2009-04-30 WO disclosed