SCHEMBL8345289

SCHEMBL8345289

CC(C)c1nc(C(C)O)n(C)c1Sc1cc(Cl)cc(Cl)c1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.32
HTR2A P28223 1/20 0.32
HTR7 P34969 1/20 0.32
HTR6 P50406 1/20 0.32
HSP90B1 P14625 3/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 1/20 0.30
TRAP1 Q12931 1/20 0.30

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
SCHEMBL8347016 0.83 HSP90B1 (0.33) HSP90B1HSP90AA1HSP90AB1TRAP1
SCHEMBL6165069 0.82 RECQL (0.30)
SCHEMBL6968462 0.81
SCHEMBL6966628 0.81 DRD2 (0.34) DRD2HTR2AHTR7HTR6HSP90B1
SCHEMBL6159218 0.81
SCHEMBL6973184 0.80 DRD2 (0.32) DRD2HTR2AHTR7HTR6
SCHEMBL6163272 0.80 HSP90B1 (0.33) DRD2HTR2AHTR7HTR6HSP90B1
SCHEMBL6966324 0.79
SCHEMBL6963215 0.78 HSP90B1 (0.32) DRD2HTR2AHTR7HTR6HSP90B1
SCHEMBL6162374 0.78 HSP90B1 (0.32) DRD2HTR2AHTR7HTR6HSP90B1

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
US-5910506-A IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC SHIONOGI & CO., LTD. (JP) 1999-06-08 US disclosed