SCHEMBL8482198

SCHEMBL8482198

OC(CC1CN(C(c2ccccc2)(c2ccccc2)c2ccccc2)CCO1)OCc1ccc2ccccc2c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 7/20 0.44
SLC1A3 P43003 1/20 0.37
SLC1A2 P43004 1/20 0.37
SLC1A1 P43005 1/20 0.37
SIGMAR1 Q99720 1/20 0.34
GBA1 P04062 2/20 0.33
UGCG Q16739 2/20 0.33
GBA2 Q9HCG7 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
KMT2A Q03164 1/20 0.33
CASR P41180 1/20 0.32
OPRL1 P41146 1/20 0.32

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
SCHEMBL8481007 0.74 DRD4 (0.41) DRD4SLC6A3KMT2A
SCHEMBL8434603 0.71 ADORA2A (0.43) DRD4DRD2DRD3
SCHEMBL27828848 0.71 ADORA2A (0.43) DRD4DRD2DRD3
SCHEMBL8480377 0.71 ADORA2A (0.43) DRD4DRD2DRD3
SCHEMBL8482174 0.68 HRH3 (0.38) DRD4SLC6A2SLC6A4SLC6A3DRD2
SCHEMBL8482170 0.68 HRH3 (0.38) DRD4SLC6A2SLC6A4SLC6A3DRD2
SCHEMBL8481010 0.68 SLC6A3 (0.40) DRD4SLC6A2SLC6A4SLC6A3
SCHEMBL8482364 0.66 PDK1 (0.40) DRD4DRD2DRD3CASR
SCHEMBL8481920 0.65 GRIN2B (0.45) DRD4SIGMAR1
SCHEMBL28025079 0.64 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1SLC6A2SLC6A4

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-5872117-A TREATING CEREBROVASCULAR DEMENTIA, SENILE DEMENTIA, ALZHEIMER'S DEMENTIA, SEQUELAE OF ISCHEMIC ENCEPHALOPATHY AND CEREBRAL APOPLEXY TOYAMA CHEMICAL CO., LTD. (JP) 1999-02-16 US disclosed