SCHEMBL10697263

SCHEMBL10697263

COC(=O)OC1CN(CCOc2ccccc2OC)CCC1=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.47
DRD3 P35462 1/20 0.47
ADRA1A P35348 3/20 0.45
ADRA1B P35368 3/20 0.45
HTR1A P08908 1/20 0.45
HTR7 P34969 1/20 0.45
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41

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
Hydrochloric Acid SCHEMBL10696916 0.99 DRD2 (0.46) DRD2DRD3ADRA1AADRA1BHTR1A
SCHEMBL10693226 0.88 DRD3 (0.45) DRD2DRD3HTR7
SCHEMBL10697140 0.84 DRD3 (0.51) DRD2DRD3
Hydrochloric Acid SCHEMBL10696092 0.83 DRD3 (0.50) DRD2DRD3
SCHEMBL10695039 0.83 OPRM1 (0.39) DRD2DRD3
SCHEMBL10696248 0.81 KCNA5 (0.45) DRD2DRD3ALDH1A1KDM4E
SCHEMBL10696548 0.80 MEN1 (0.49) DRD2DRD3ALDH1A1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL10696621 0.80 KCNA5 (0.44) DRD2DRD3ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL10696599 0.80 MEN1 (0.48) DRD2DRD3ALDH1A1L3MBTL1MEN1
SCHEMBL7487266 0.77 TACR1 (0.54) DRD2

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-0252876-A1 Hydrogenated 1-phenoxyalkylpyridine-3-carboxylic-acid compounds CIBA-GEIGY AG (CH) 1988-01-13 EP claimed