SCHEMBL9470568

SCHEMBL9470568

O=S(=O)(Oc1cccc(-c2ccccc2)c1OS(=O)(=O)C(F)(F)F)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.39
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
DRD3 P35462 6/20 0.36
DRD1 P21728 4/20 0.36
DRD4 P21917 4/20 0.36
DRD5 P21918 4/20 0.36
HTR1D P28221 2/20 0.35
PTGS2 P35354 2/20 0.35

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
SCHEMBL21811791 0.90 PTGS2 (0.39) DRD2PTGS2
SCHEMBL367003 0.86 DRD2 (0.42) DRD2TDP1L3MBTL1DRD3DRD1
SCHEMBL1638205 0.84 RXRA (0.43) TDP1L3MBTL1
SCHEMBL66020 0.84 DRD2 (0.40) DRD2DRD3DRD1DRD4DRD5
SCHEMBL30705191 0.84 DRD2 (0.44) DRD2DRD3DRD1DRD4DRD5
SCHEMBL28166225 0.83 PTGS2 (0.41) DRD2TDP1L3MBTL1DRD3DRD1
SCHEMBL22031048 0.83 KCNH2 (0.40) DRD2L3MBTL1DRD3PTGS2
SCHEMBL12646855 0.82 KDM4E (0.42) DRD2DRD3DRD1DRD4DRD5
SCHEMBL28014198 0.81 DRD2 (0.40) DRD2DRD3DRD1DRD4DRD5
SCHEMBL7023211 0.81 DRD2 (0.42) DRD2DRD3DRD1DRD4DRD5

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-5241044-A Soluble poly(p-phenylene)s EDISON POLYMER INNOVATION CORPORATION (US) 1993-08-31 US disclosed