SCHEMBL7788940

SCHEMBL7788940

CCCCCc1ccc(-c2ccccc2)c(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.42
CTSL P07711 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
LIPG Q9Y5X9 1/20 0.41
TSHR P16473 2/20 0.40
CYP3A4 P08684 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
ALOX5 P09917 1/20 0.40
TYR P14679 1/20 0.40
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GPR84 Q9NQS5 1/20 0.40
RARB P10826 1/20 0.39
GCGR P47871 2/20 0.38
GPR3 P46089 1/20 0.38

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
SCHEMBL7786742 0.98 LIPG (0.44) HSD11B1CTSLCTSSCTSKLIPG
SCHEMBL7781693 0.98 LIPG (0.44) HSD11B1CTSLCTSSCTSKLIPG
SCHEMBL9496996 0.97 HSD11B1 (0.43) HSD11B1CTSLCTSSCTSKLIPG
SCHEMBL9493503 0.95 HSD11B1 (0.42) HSD11B1CTSLCTSSCTSKLIPG
SCHEMBL9492882 0.95 HSD11B1 (0.42) HSD11B1CTSLCTSSCTSKLIPG
SCHEMBL17108393 0.91 TYR (0.43) HSD11B1CTSLCTSSCTSKLIPG
SCHEMBL28382461 0.88 CTSL (0.51) HSD11B1CTSLCTSSCTSKMAPT
SCHEMBL9446108 0.86 HSD11B1 (0.39) HSD11B1LIPGTSHRCYP3A4MAPT
SCHEMBL9563854 0.85 RARB (0.50) HSD11B1LIPGTSHRCYP3A4MAPT
SCHEMBL11933070 0.85 TYR (0.42) CTSLCTSSCTSKLIPGTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103086850-B Preparation method of CF2O-containing compound, and intermediate compound and preparation method thereof LIANHE CHEMICAL TECHNOLOGY CO LTD 2014-12-24 CN claimed
CN-103086850-B Preparation method of CF2O-containing compound, and intermediate compound and preparation method thereof LIANHE CHEMICAL TECHNOLOGY CO LTD 2014-12-24 CN disclosed
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
EP-0362318-A1 2,3-DIFLUOROBIPHENYLS. MERCK PATENT GMBH (DE) 1990-04-11 EP disclosed
WO-1989008687-A1 2,3-DIFLUOROBIPHENYLS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-09-21 WO disclosed