SCHEMBL680993

SCHEMBL680993

CC(O)COc1c(Br)cc(Br)cc1Br

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
LMNA P02545 2/20 0.42
THRB P10828 5/20 0.41
THRA P10827 4/20 0.41
ALDH1A1 P00352 1/20 0.41
ATM Q13315 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 2/20 0.39
HSD17B10 Q99714 1/20 0.38
ALOX15 P16050 1/20 0.37
ALOX12 P18054 1/20 0.37
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
CYP3A4 P08684 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL3723175 0.88 THRB (0.45) TSHRLMNATHRBTHRAALDH1A1
SCHEMBL18780396 0.86 ATM (0.42) TSHRLMNATHRBTHRAALDH1A1
SCHEMBL6829530 0.85 THRB (0.46) TSHRLMNATHRBTHRAALDH1A1
SCHEMBL7067636 0.84 THRB (0.38) TSHRLMNATHRBTHRAALDH1A1
SCHEMBL5478851 0.83 TSHR (0.58) TSHRLMNATHRBTHRAALDH1A1
SCHEMBL3625859 0.82 ALDH1A1 (0.64) TSHRLMNATHRBTHRAALDH1A1
SCHEMBL14886924 0.82 THRB (0.41) TSHRLMNATHRBTHRAALDH1A1
SCHEMBL676691 0.81 TSHR (0.52) TSHRLMNATHRBTHRAALDH1A1
SCHEMBL11578752 0.80 THRB (0.40) TSHRLMNATHRBTHRAALDH1A1
SCHEMBL11691799 0.80 ALDH1A1 (0.41) TSHRLMNATHRBTHRAALDH1A1

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114848640-B Application of compound in preparation of anti-inflammatory drugs 山东第一医科大学(山东省医学科学院) 2023-04-07 CN claimed
CN-114848640-A Application of compound in preparation of anti-inflammatory drugs 山东第一医科大学(山东省医学科学院) 2022-08-05 CN claimed
CN-114605315-A Optical isomer of compound, preparation method and application thereof 山东第一医科大学(山东省医学科学院) 2022-06-10 CN claimed
CN-115385847-B Polysubstituted diaryl compound, preparation method and application thereof 山东第一医科大学(山东省医学科学院) 2023-09-29 CN disclosed
CN-114848640-B Application of compound in preparation of anti-inflammatory drugs 山东第一医科大学(山东省医学科学院) 2023-04-07 CN disclosed
CN-115385847-A Polysubstituted diaryl compound and preparation method and application thereof 山东第一医科大学(山东省医学科学院) 2022-11-25 CN disclosed
CN-113387873-B Substituted diaryl compound, preparation method and application thereof 山东第一医科大学(山东省医学科学院) 2022-09-20 CN disclosed
CN-114848640-A Application of compound in preparation of anti-inflammatory drugs 山东第一医科大学(山东省医学科学院) 2022-08-05 CN disclosed
CN-114605315-A Optical isomer of compound, preparation method and application thereof 山东第一医科大学(山东省医学科学院) 2022-06-10 CN disclosed
CN-114605315-A Optical isomer of compound, preparation method and application thereof 山东第一医科大学(山东省医学科学院) 2022-06-10 CN disclosed
EP-3281542-B1 POLYESTER FIBERS FOR ARTIFICIAL HAIR, PROCESS FOR PRODUCING SAME, AND HAIR ORNAMENT PRODUCT INCLUDING SAME KANEKA CORP (JP) 2021-05-05 EP disclosed
US-20130102703-A1 HIGH IMPACT POLYSTYRENE FLAME RETARDED COMPOSITIONS BAR-YAAKOV YOAV (IL) 2013-04-25 US disclosed
US-20120309869-A1 FLAME RETARDED COMPOSITIONS BROMINE COMPOUNDS LTD. (IL) 2012-12-06 US disclosed
WO-2012127463-A1 FLAME RETARDANT COMPOSITION AND FLAME RETARDED HIGH IMPACT POLYPROPYLENE BROMINE COMPOUNDS LTD. (IL) 2012-09-27 WO disclosed
US-8067497-B2 Flame-retardant for engineering thermoplastic applications BROMINE COMPOUNDS LTD. (IL) 2011-11-29 US disclosed
US-20110160362-A1 FLAME-RETARDED COMPOSITIONS OF STYRENE-CONTAINING POLYMERS BROMINE COMPOUNDS LTD. 2011-06-30 US disclosed
US-7754792-B2 Flame-retardant polyester artificial hair KANEKA CORPORATION (JP) 2010-07-13 US disclosed
US-20100113630-A1 Flame retardant Composition BROMINE COMPOUNDS LTD. (IL) 2010-05-06 US disclosed
US-20080085957-A1 Flame-Retardant Polyester Artificial Hair KANEKA CORPORATION (JP) 2008-04-10 US disclosed
EP-0338587-A2 Recording material KAO CORPORATION (JP) 1989-10-25 EP disclosed