SCHEMBL4952807

SCHEMBL4952807

CC1(C)CC(=O)c2cc(OS(=O)(=O)C(F)(F)F)ccc2S1.COC1C(=O)c2ccccc2SC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.39
DRD2 P14416 3/20 0.39
DRD4 P21917 3/20 0.39
DRD3 P35462 3/20 0.39

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
SCHEMBL1140782 0.85 CHRM1 (0.41) CHRM1DRD2DRD4DRD3
SCHEMBL727285 0.82 KDM4E (0.40) CHRM1DRD2DRD4DRD3
SCHEMBL728727 0.73 LMNA (0.32)
SCHEMBL1140756 0.68 ALDH1A1 (0.47)
SCHEMBL8771675 0.66 DRD2 (0.39) CHRM1DRD2DRD4DRD3
SCHEMBL6086566 0.64 VHL (0.50) CHRM1DRD2DRD4DRD3
SCHEMBL1091438 0.64 PGR (0.45) CHRM1DRD2DRD4DRD3
SCHEMBL6086547 0.63 KDM4E (0.59)
SCHEMBL8606021 0.63 ALDH1A1 (0.37)
SCHEMBL31669018 0.63 CHRM1 (0.43) CHRM1DRD2DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1648397-A4 EX VIVO PROGENITOR AND STEM CELL EXPANSION FOR USE IN THE TREATMENT OF DISEASE OF ENDODERMALLY-DERIVED ORGANS GAMIDA CELL LTD (IL) 2008-05-21 EP disclosed
EP-1649007-A4 METHODS FOR EX-VIVO EXPANDING STEM/PROGENITOR CELLS GAMIDA CELL LTD (IL) 2008-05-14 EP disclosed
EP-1649007-A2 METHODS FOR EX-VIVO EXPANDING STEM/PROGENITOR CELLS Gamida Cell Ltd. (IL) 2006-04-26 EP disclosed
EP-1648397-A2 EX VIVO PROGENITOR AND STEM CELL EXPANSION FOR USE IN THE TREATMENT OF DISEASE OF ENDODERMALLY-DERIVED ORGANS Gamida Cell Ltd. (IL) 2006-04-26 EP disclosed
WO-2005007073-A2 EX VIVO PROGENITOR AND STEM CELL EXPANSION FOR USE IN THE TREATMENT OF DISEASE OF ENDODERMALLY-DERIVED ORGANS GAMIDA-CELL LTD. (IL) 2005-01-27 WO disclosed
WO-2005007799-A2 METHODS FOR EX-VIVO EXPANDING STEM/PROGENITOR CELLS GAMIDA-CELL LTD. (IL) 2005-01-27 WO disclosed