SCHEMBL9205633

SCHEMBL9205633

Nc1cccc(OCCCNC[C@H]2COc3ccc(O)cc3O2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.53
DRD4 P21917 2/20 0.53
DRD3 P35462 2/20 0.53

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
SCHEMBL9210884 1.00 DRD2 (0.53) DRD2DRD4DRD3
SCHEMBL9205645 1.00 DRD2 (0.53) DRD2DRD4DRD3
SCHEMBL9203919 0.96 DRD2 (0.48) DRD2DRD4DRD3
SCHEMBL9214181 0.89 CA1 (0.59)
SCHEMBL9207882 0.89 CA1 (0.59)
SCHEMBL9205652 0.88 CA2 (0.49) DRD2DRD4DRD3
SCHEMBL9207245 0.88 ADRA1D (0.49)
SCHEMBL9207871 0.88 ADRA1D (0.49)
SCHEMBL9205887 0.88 ADRA1D (0.49)
SCHEMBL9207474 0.87 ADRA1D (0.53)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520674-B1 Antipsychotic benzodioxan derivatives AMERICAN HOME PROD (US) 1995-08-16 EP claimed
EP-0520674-B1 Antipsychotic benzodioxan derivatives AMERICAN HOME PROD (US) 1995-08-16 EP disclosed
EP-0520674-A1 Antipsychotic benzodioxan derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1992-12-30 EP disclosed
US-5126366-A Antidepressants, antipsychotics, anxiolytic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1992-06-30 US disclosed