SCHEMBL7790562

SCHEMBL7790562

CCCCCCCCCc1ccc(-c2cccc(F)c2F)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 7/20 0.52
HTR2A P28223 1/20 0.50
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
RARA P10276 2/20 0.49
RARG P13631 1/20 0.49
HSD11B1 P28845 3/20 0.47
HSD17B10 Q99714 2/20 0.46
TSHR P16473 1/20 0.46
PLK1 P53350 2/20 0.46
ESR1 P03372 2/20 0.46
ADRA2A P08913 2/20 0.46
ADORA3 P0DMS8 2/20 0.46
TACR2 P21452 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46

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
SCHEMBL7788958 1.00 RARB (0.52) RARBHTR2AHDAC3HDAC1HDAC2
SCHEMBL9497766 1.00 RARB (0.52) RARBHTR2AHDAC3HDAC1HDAC2
SCHEMBL9496656 1.00 RARB (0.52) RARBHTR2AHDAC3HDAC1HDAC2
SCHEMBL9497689 1.00 RARB (0.52) RARBHTR2AHDAC3HDAC1HDAC2
SCHEMBL9495390 0.98 RARB (0.51) RARBHTR2AHDAC3HDAC1HDAC2
SCHEMBL9563803 0.98 RARB (0.51) RARBHTR2AHDAC3HDAC1HDAC2
SCHEMBL9493032 0.98 RARB (0.51) RARBHTR2AHDAC3HDAC1HDAC2
SCHEMBL9493571 0.98 RARB (0.51) RARBHTR2AHDAC3HDAC1HDAC2
SCHEMBL9493350 0.98 RARB (0.51) RARBHTR2AHDAC3HDAC1HDAC2
SCHEMBL9563877 0.98 RARB (0.51) RARBHTR2AHDAC3HDAC1HDAC2

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-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
US-5273680-A A chiral tilted smectic liquid crystal based on terphenyls MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-12-28 US disclosed
EP-0329752-B1 FLUORINATED OLIGOPHENYLS AND THEIR USE IN LIQUID CRYSTAL MATERIALS MERCK PATENT GmbH (DE) 1993-03-17 EP disclosed
EP-0329752-A1 FLUORINATED OLIGOPHENYLS AND THEIR USE IN LIQUID CRYSTAL MATERIALS MERCK PATENT GmbH (DE) 1989-08-30 EP disclosed