SCHEMBL10794873

SCHEMBL10794873

CCOC(=O)NCCOc1ccc(OC(C)CC(C)C)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50
SLC6A3 Q01959 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
MAPT P10636 1/20 0.49
MAPK1 P28482 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
GLA P06280 1/20 0.46
NPC1 O15118 2/20 0.45
ACACB O00763 1/20 0.44
MTNR1A P48039 2/20 0.43
MTNR1B P49286 2/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL9856365 0.91 L3MBTL1 (0.50) SLC6A2SLC6A4SLC6A3L3MBTL1MAPT
SCHEMBL9856468 0.88 MAPK1 (0.49) SLC6A2SLC6A4SLC6A3L3MBTL1MAPT
SCHEMBL10394911 0.86 MAPK1 (0.53) L3MBTL1MAPTMAPK1SMN1; SMN2KMT2A
SCHEMBL10794790 0.84 TAS1R3 (0.47) SLC6A2SLC6A4SLC6A3L3MBTL1MAPT
SCHEMBL10395699 0.83 L3MBTL1 (0.46) SLC6A2SLC6A4SLC6A3L3MBTL1MAPT
SCHEMBL9856275 0.82 L3MBTL1 (0.47) SLC6A2SLC6A4SLC6A3L3MBTL1MAPT
SCHEMBL11886540 0.82 NPC1 (0.65) L3MBTL1MAPTMAPK1SMN1; SMN2KMT2A
SCHEMBL9856673 0.82 MAPT (0.49) L3MBTL1MAPTMAPK1SMN1; SMN2KMT2A
SCHEMBL10394215 0.81 L3MBTL1 (0.46) SLC6A2SLC6A4SLC6A3L3MBTL1MAPT
SCHEMBL9856035 0.80 L3MBTL1 (0.59) L3MBTL1MAPTMAPK1SMN1; SMN2KMT2A

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
US-4697033-A INSECTICIDES SANDOZ LTD. (CH) 1987-09-29 US disclosed