SCHEMBL8819853

SCHEMBL8819853

C1=CC(c2ccc3ccsc3c2)CCN1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
CHRNA7 P36544 4/20 0.32
HTR3A P46098 3/20 0.32
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
HTR3D Q70Z44 1/20 0.31
HTR3C Q8WXA8 1/20 0.31
GID4 Q8IVV7 1/20 0.31

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
SCHEMBL19756730 0.72 SLC6A4 (0.44) SLC6A2SLC6A4SLC6A3CHRNA7HTR3A
SCHEMBL28905147 0.71 L3MBTL1 (0.51) SLC6A2SLC6A4SLC6A3CHRNA7
SCHEMBL7138055 0.70 MAPT (0.42) SLC6A2SLC6A4SLC6A3
SCHEMBL6573927 0.69 PPARD (0.32)
SCHEMBL8976942 0.67 PRCP (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL655217 0.67 HTR3A (0.43) SLC6A2SLC6A4SLC6A3CHRNA7HTR3A
SCHEMBL4169709 0.67 SLC18A3 (0.42) SLC6A2SLC6A4GID4
SCHEMBL7416329 0.66 ALDH1A1 (0.36)
Hydrochloric Acid SCHEMBL4470943 0.66 HTR3A (0.42) SLC6A2SLC6A4SLC6A3CHRNA7HTR3A
SCHEMBL5584370 0.66 SLC6A4 (0.40) SLC6A2SLC6A4SLC6A3CHRNA7HTR3A

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-1997047302-A1 INHIBITION OF SEROTONIN REUPTAKE ELI LILLY AND COMPANY (US) 1997-12-18 WO disclosed
WO-1996022290-A1 COMPOUNDS HAVING EFFECTS ON SEROTONIN-RELATED SYSTEMS ELI LILLY AND COMPANY (US) 1996-07-25 WO disclosed