SCHEMBL7860144

SCHEMBL7860144

CCCN(CCC)[C@H]1Cc2ccc(CS(=O)(=O)c3ccccc3)cc2C1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 9/20 0.66
DRD2 P14416 5/20 0.66
HTR1A P08908 1/20 0.46
FYN P06241 1/20 0.46
DRD4 P21917 1/20 0.45

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
SCHEMBL7854627 0.88 DRD3 (0.67) DRD3DRD2FYN
SCHEMBL7861355 0.86 DRD3 (0.55) DRD3DRD2HTR1AFYN
SCHEMBL7860284 0.85 DRD3 (0.63) DRD3DRD2FYN
SCHEMBL8900096 0.83 DRD3 (0.61) DRD3DRD2FYN
SCHEMBL7864930 0.83 DRD3 (0.61) DRD3DRD2FYN
SCHEMBL7864498 0.82 DRD3 (0.51) DRD3DRD2HTR1A
SCHEMBL626977 0.78 DRD3 (1.00) DRD3DRD2DRD4
SCHEMBL29448456 0.78 DRD3 (1.00) DRD3DRD2DRD4
SCHEMBL8899133 0.77 DRD3 (0.60) DRD3DRD2HTR1AFYNDRD4
SCHEMBL7862705 0.77 DRD3 (0.60) DRD3DRD2HTR1AFYNDRD4

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-0807101-B1 2-AMINOINDANS AS SELECTIVE DOPAMINE D3 LIGANDS UPJOHN CO (US) 2001-06-13 EP disclosed
US-5936000-A 2-aminoindans as selective dopamine D3 ligands PHARMACIA & UPJOHN COMPANY (US) 1999-08-10 US disclosed
WO-1996023760-A1 2-AMINOINDANS AS SELECTIVE DOPAMINE D3 LIGANDS PHARMACIA & UPJOHN COMPANY (US) 1996-08-08 WO disclosed