SCHEMBL22723960

SCHEMBL22723960

Cc1cnc(CC(=O)/N=C/C2CCC(CCN3CCc4sc(C5CC(F)(F)C5)nc4C3)CC2)o1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 20/20 0.75
▸ DRD2 P14416 19/20 0.75

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
SCHEMBL22723762 0.89 DRD3 (0.62) DRD3DRD2
SCHEMBL22961635 0.85 DRD3 (1.00) DRD3DRD2
SCHEMBL22961539 0.85 DRD3 (1.00) DRD3DRD2
SCHEMBL22723850 0.84 DRD3 (0.74) DRD3DRD2
SCHEMBL22724109 0.84 DRD3 (0.54) DRD3DRD2
SCHEMBL22723933 0.79 DRD3 (0.61) DRD3DRD2
SCHEMBL22723899 0.79 DRD3 (0.76) DRD3DRD2
SCHEMBL21041973 0.75 DRD3 (0.78) DRD3DRD2
SCHEMBL22724108 0.74 DRD3 (0.82) DRD3DRD2
SCHEMBL22961541 0.72 DRD3 (0.60) DRD3DRD2

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-3744721-A1 CONDENSED CYCLIC COMPOUND HAVING DOPAMINE D3 RECEPTOR ANTAGONISM Shionogi & Co., Ltd (JP) 2020-12-02 — — EP disclosed
Send feedback