SCHEMBL23097596

SCHEMBL23097596

Cc1ccc(N2CCN(CCCOc3ccc4[nH]c(=O)ccc4c3)CC2)cc1C

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.59
DRD3 P35462 6/20 0.59
DRD4 P21917 4/20 0.59
KCNH2 Q12809 1/20 0.52
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50

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
SCHEMBL23097784 0.90 DRD2 (0.61) DRD2DRD3DRD4KCNH2SLC6A2
SCHEMBL23097661 0.88 DRD3 (0.65) DRD2DRD3DRD4KCNH2SLC6A2
SCHEMBL23097788 0.88 DRD2 (0.66) DRD2DRD3DRD4KCNH2SLC6A2
SCHEMBL23097599 0.87 DRD2 (0.60) DRD2DRD3DRD4KCNH2SLC6A2
SCHEMBL23097749 0.86 DRD2 (0.58) DRD2DRD3DRD4KCNH2SLC6A2
SCHEMBL23097605 0.86 DRD2 (0.59) DRD2DRD3DRD4KCNH2SLC6A2
SCHEMBL23097671 0.86 DRD2 (0.56) DRD2DRD3DRD4KCNH2SLC6A2
SCHEMBL23097704 0.86 KCNH2 (0.59) DRD2DRD3DRD4KCNH2SLC6A2
SCHEMBL23097677 0.86 KCNH2 (0.69) DRD2DRD3DRD4KCNH2SLC6A2
SCHEMBL23097672 0.86 SLC6A2 (0.69) DRD2DRD3DRD4KCNH2SLC6A2

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