SCHEMBL9779282

SCHEMBL9779282

O=S(=O)(c1cccc(Oc2ccc(OC(F)(F)C(F)(F)F)cc2)c1)c1cccc(Oc2ccc(OC(F)(F)C(F)(F)F)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PTGES2 Q9H7Z7 1/20 0.44
PGR P06401 7/20 0.42
NR3C1 P04150 2/20 0.42
AR P10275 1/20 0.42
ESR2 Q92731 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
ABCC9 O60706 1/20 0.40
ABCC8 Q09428 1/20 0.40
KCNJ11 Q14654 1/20 0.40
KCNJ8 Q15842 1/20 0.40
NR1H2 P55055 4/20 0.38
NR1H3 Q13133 4/20 0.38
SOS1 Q07889 1/20 0.37
SDHB P21912 1/20 0.36

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
SCHEMBL9779035 0.92 PTGES2 (0.42) HTTTDP1L3MBTL1PTGES2PGR
SCHEMBL9779047 0.88 HTT (0.54) HTTTDP1L3MBTL1PTGES2PGR
SCHEMBL9779001 0.88 PTGES2 (0.54) HTTTDP1L3MBTL1PTGES2PGR
SCHEMBL9778890 0.84 HTT (0.47) HTTTDP1L3MBTL1NR3C1SMN1; SMN2
SCHEMBL9778880 0.80 PGR (0.59) HTTTDP1L3MBTL1PGRNR3C1
SCHEMBL9778961 0.80 PTGES2 (0.52) HTTTDP1L3MBTL1PTGES2ABCC9
SCHEMBL9778844 0.79 SOS1 (0.53) HTTTDP1L3MBTL1PGRNR3C1
SCHEMBL9779108 0.78 HTT (0.56) HTTTDP1L3MBTL1PGRSMN1; SMN2
SCHEMBL3672508 0.78 HTT (0.52) HTTTDP1L3MBTL1PTGES2PGR
SCHEMBL3677240 0.78 HTT (0.52) HTTTDP1L3MBTL1PTGES2PGR

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-5066409-A Novel aryl ether sulfones THE DOW CHEMICAL COMPANY (US) 1991-11-19 US disclosed