SCHEMBL11240643

SCHEMBL11240643

COc1cc(NC(C)=O)c(Cl)cc1C(=O)NC1CC2COCC(C1)N2Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.52
DRD4 P21917 12/20 0.51
DRD3 P35462 4/20 0.46
DRD5 P21918 1/20 0.46

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
SCHEMBL11240647 1.00 DRD2 (0.52) DRD2DRD4DRD3DRD5
SCHEMBL11237343 0.90 DRD2 (0.63) DRD2DRD4DRD3
SCHEMBL11243700 0.90 DRD2 (0.63) DRD2DRD4DRD3
SCHEMBL11236512 0.88 DRD2 (0.67) DRD2DRD4DRD3
SCHEMBL11236508 0.88 DRD2 (0.67) DRD2DRD4DRD3
SCHEMBL11244187 0.86 DRD2 (0.53) DRD2DRD4DRD3
SCHEMBL11238538 0.86 DRD2 (0.53) DRD2DRD4DRD3
SCHEMBL11242259 0.86 DRD2 (0.54) DRD2DRD4DRD3
SCHEMBL11243730 0.86 DRD2 (0.54) DRD2DRD4DRD3
SCHEMBL11235259 0.86 DRD2 (0.53) DRD2DRD4DRD3

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
US-4352802-A DESALINATION OF SEA WATER BEECHAM GROUP LIMITED (GB) 1982-10-05 US claimed
EP-0041817-A1 Benzamide derivatives, process for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1981-12-16 EP claimed
US-4352802-A DESALINATION OF SEA WATER BEECHAM GROUP LIMITED (GB) 1982-10-05 US disclosed
EP-0041817-A1 Benzamide derivatives, process for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1981-12-16 EP disclosed