SCHEMBL9868987

SCHEMBL9868987

CCN1CCCC1CNC(=O)c1cc(S(=O)(=O)CC2CC2)cc2c1OCCC2

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.51
ADRA2B P18089 1/20 0.51
ADRA2C P18825 1/20 0.51
SLC6A4 P31645 1/20 0.51
DRD3 P35462 1/20 0.51
HTR2B P41595 1/20 0.51
KCNH2 Q12809 1/20 0.51
HRH3 Q9Y5N1 1/20 0.51

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
SCHEMBL9823019 0.93 DRD2 (0.48) DRD2
SCHEMBL9822683 0.90 DRD2 (0.51) DRD2ADRA2BADRA2CSLC6A4DRD3
Hydrochloric Acid SCHEMBL9868756 0.89 DRD2 (0.51) DRD2ADRA2BADRA2CSLC6A4DRD3
SCHEMBL10810631 0.88 CA2 (0.60) DRD2DRD3
SCHEMBL9868144 0.84 DRD2 (0.51) DRD2ADRA2BADRA2CSLC6A4DRD3
Water SCHEMBL10806339 0.83 CA2 (0.60) DRD2DRD3
SCHEMBL9822699 0.82 DRD2 (0.47) DRD2ADRA2BADRA2CSLC6A4DRD3
SCHEMBL11366374 0.81 DRD2 (0.60) DRD2ADRA2BADRA2CSLC6A4DRD3
Hydrochloric Acid SCHEMBL11258188 0.80 DRD2 (0.59) DRD2ADRA2BADRA2CSLC6A4DRD3
SCHEMBL11265100 0.80 DRD2 (0.61) DRD2ADRA2BADRA2CSLC6A4DRD3

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-5006570-A Dihydrobenzofuran- and chroman-carboxamide derivatives, processes for the preparation thereof and use thereof as neuroleptics LABORATOIRES DELAGRANGE (FR) 1991-04-09 US disclosed