SCHEMBL24489459

SCHEMBL24489459

CN1CCC(c2cccc(S(C)(=O)=O)c2)CC1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.72
SIGMAR1 Q99720 1/20 0.72
DRD3 P35462 4/20 0.60
HTR6 P50406 5/20 0.54
HRH3 Q9Y5N1 1/20 0.52
JAK2 O60674 2/20 0.47
JAK3 P52333 2/20 0.47
PTK2 Q05397 2/20 0.47
CYP3A4 P08684 1/20 0.47
JAK1 P23458 1/20 0.47
QDPR P09417 1/20 0.47
HTR2A P28223 3/20 0.47
HTR2C P28335 3/20 0.47

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
SCHEMBL24612002 0.87 DRD2 (0.66) DRD2SIGMAR1DRD3HTR6HTR2C
SCHEMBL18408681 0.86 DRD2 (0.67) DRD2SIGMAR1DRD3HTR6HRH3
SCHEMBL15450839 0.86 DRD2 (0.67) DRD2SIGMAR1DRD3HTR6HRH3
Pridopidine SCHEMBL29664816 0.84 DRD2 (1.00) DRD2SIGMAR1DRD3HTR6
Pridopidine SCHEMBL166748 0.84 DRD2 (1.00) DRD2SIGMAR1DRD3HTR6
SCHEMBL4828684 0.84 DRD2 (0.64) DRD2SIGMAR1DRD3HTR6HRH3
SCHEMBL4824639 0.84 DRD2 (0.80) DRD2SIGMAR1DRD3HTR6HRH3
SCHEMBL22458966 0.84 DRD2 (0.64) DRD2SIGMAR1DRD3HTR6HRH3
SCHEMBL10181371 0.83 DRD2 (0.62) DRD2SIGMAR1DRD3HTR6
Pridopidine SCHEMBL15007479 0.83 DRD2 (0.97) DRD2SIGMAR1DRD3HTR6

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
EP-3325443-B1 PROCESS FOR PREPARING PRIDOPIDINE Prilenia Neurotherapeutics Ltd (IL) 2022-06-08 EP disclosed