SCHEMBL7448312

SCHEMBL7448312

CN(CCNc1cccc2c1CC(=O)N2)Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.45
DRD4 P21917 3/20 0.45
DRD3 P35462 3/20 0.45
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
CHRM2 P08172 1/20 0.41
CYP3A4 P08684 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
ADRA2B P18089 1/20 0.41
DRD1 P21728 1/20 0.41
DRD5 P21918 1/20 0.41
HTR2A P28223 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
ADRA1A P35348 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 SCHEMBL7443067 0.99 DRD2 (0.44) DRD2DRD4DRD3ALDH1A1SMN1; SMN2
SCHEMBL7443236 0.78 DRD2 (0.63) DRD2DRD4DRD3ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL7443683 0.77 DRD2 (0.62) DRD2DRD4DRD3ALDH1A1SMN1; SMN2
SCHEMBL7471585 0.77 DRD2 (0.61) DRD2DRD4DRD3LMNA
SCHEMBL1233895 0.71 DHPS (0.45) DRD2DRD4DRD3KDM4ELMNA
SCHEMBL10917036 0.71 DRD2 (0.49) DRD2DRD4DRD3ALDH1A1KDM4E
SCHEMBL837797 0.71 DHPS (0.51) DRD2DRD4DRD3KDM4ELMNA
SCHEMBL837816 0.70 DRD2 (0.45) DRD2DRD4DRD3ALDH1A1SMN1; SMN2
SCHEMBL7381878 0.69 DRD2 (0.68) DRD2DRD4DRD3KDM4ELMNA
SCHEMBL7381876 0.69 DRD2 (0.45) DRD2DRD4DRD3ALDH1A1KDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1073636-A1 4-AMINO-(ETHYLAMINO)-OXINDOLE DOPAMINE AUTORECEPTOR AGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 2001-02-07 EP claimed
WO-1999052870-A1 4-AMINO-(ETHYLAMINO)-OXINDOLE DOPAMINE AUTORECEPTOR AGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-10-21 WO claimed
CN-1297439-A 4-amino-(ethylamino)-oxindole dopamine autoreceptor agonists AMERICAN HOME PROD (US) 2001-05-30 CN disclosed