SCHEMBL23097573

SCHEMBL23097573

O=c1ccc2cc(OCCCN3CCN(c4ccc(F)cc4)CC3)ccc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.65
SLC6A4 P31645 3/20 0.65
DRD2 P14416 11/20 0.61
DRD3 P35462 8/20 0.61
DRD4 P21917 4/20 0.61
HTR1A P08908 3/20 0.57
HTR2A P28223 3/20 0.57
DRD1 P21728 1/20 0.57
DRD5 P21918 1/20 0.57
HRH1 P35367 2/20 0.57
TMEM97 Q5BJF2 2/20 0.57
SIGMAR1 Q99720 2/20 0.57
KCNH2 Q12809 1/20 0.56

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
SCHEMBL23097671 0.90 DRD2 (0.56) SLC6A2SLC6A4DRD2DRD3DRD4
SCHEMBL23097784 0.90 DRD2 (0.61) SLC6A2SLC6A4DRD2DRD3DRD4
SCHEMBL23097677 0.90 KCNH2 (0.69) SLC6A2SLC6A4DRD2DRD3DRD4
SCHEMBL23097672 0.90 SLC6A2 (0.69) SLC6A2SLC6A4DRD2DRD3DRD4
SCHEMBL23097788 0.90 DRD2 (0.66) SLC6A2SLC6A4DRD2DRD3DRD4
SCHEMBL23097704 0.90 KCNH2 (0.59) SLC6A2SLC6A4DRD2DRD3DRD4
SCHEMBL10668573 0.89 DRD3 (0.71) SLC6A2SLC6A4DRD2DRD3DRD4
SCHEMBL23097790 0.89 SLC6A4 (0.67) SLC6A2SLC6A4DRD2DRD3DRD4
SCHEMBL23097644 0.89 DRD2 (0.58) SLC6A2SLC6A4DRD2DRD3DRD4
SCHEMBL23097605 0.88 DRD2 (0.59) SLC6A2SLC6A4DRD2DRD3DRD4

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-2170334-B1 NMDA RECEPTOR ANTAGONISTS FOR NEUROPROTECTION UNIV EMORY (US) 2021-03-17 EP disclosed