SCHEMBL7789312

SCHEMBL7789312

CCCCCCCCOc1c(F)cc(-c2ccccc2)c(F)c1F

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 2/20 0.49
PTPN1 P18031 2/20 0.42
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
PTPN11 Q06124 5/20 0.40
LTA4H P09960 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
HDAC8 Q9BY41 1/20 0.38
RARB P10826 1/20 0.38
TSHR P16473 1/20 0.37

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
SCHEMBL9149250 0.86 SOAT1 (0.47) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL16428906 0.82 SOAT1 (0.47) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL4428671 0.78 SOAT1 (0.52) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL10447508 0.77 SOAT1 (0.49) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL10429653 0.77 SOAT1 (0.49) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL9561559 0.77 SOAT1 (0.48) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL10447186 0.76 PTPN11 (0.47) SOAT1THRATHRBPTPN11RARB
SCHEMBL17447398 0.75 PTPN11 (0.54) SOAT1PTPN1PTPN11LTA4HHDAC8
SCHEMBL27495357 0.75 SOAT1 (0.49) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL7755836 0.75 RARB (0.36) RARBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144546-A3 FLUORINATED TERPHENYLS QinetiQ Limited (GB) 2002-08-28 EP disclosed
EP-1144546-A2 FLUORINATED TERPHENYLS QinetiQ Limited (GB) 2001-10-17 EP disclosed
WO-2000004111-A2 FLUORINATED TERPHENYLS THE SECRETARY OF STATE FOR DEFENCE (GB) 2000-01-27 WO disclosed