SCHEMBL5052389

SCHEMBL5052389

CC(C)(c1ccc(OC(F)=C(F)F)cc1)c1ccc(OC(F)=C(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.43
HPGD P15428 3/20 0.43
TSHR P16473 3/20 0.43
ESR2 Q92731 3/20 0.43
CYP3A4 P08684 2/20 0.43
AR P10275 2/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
HTR6 P50406 1/20 0.43
ESRRG P62508 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 4/20 0.38
MAPT P10636 4/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
TP53 P04637 2/20 0.37
HIF1A Q16665 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL1505720 0.88 MAPT (0.38) ESR1ESR2ALDH1A1MAPTMEN1
SCHEMBL12200936 0.88 MAPT (0.49) HPGDTSHRHSD17B10ALDH1A1MAPT
SCHEMBL15127545 0.87 RXRA (0.47) TSHRHSD17B10ALDH1A1MAPTKMT2A
SCHEMBL15127226 0.87 MAPT (0.33) ESR1HPGDTSHRESR2CYP3A4
SCHEMBL14802719 0.82 KIF11 (0.35) MAPTMEN1KMT2ATDP1L3MBTL1
SCHEMBL4530562 0.82 RAB9A (0.35) ESR1ESR2HSD17B10ALDH1A1MAPT
SCHEMBL12834526 0.81 HSD11B1 (0.43) ESR2HSD17B10ALDH1A1MAPTMEN1
SCHEMBL8639066 0.81 ESR1 (0.50) ESR1ESR2CYP3A4ALDH1A1MAPT
SCHEMBL12834528 0.81 ESR1 (0.50) ESR1HPGDTSHRESR2CYP3A4
SCHEMBL5329906 0.79 MAPT (0.32) MAPTTDP1L3MBTL1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996028755-A1 ALIGNMENT LAYER FOR A LIQUID CRYSTAL IN A LIQUID CRYSTAL DISPLAY DEVICE THE DOW CHEMICAL COMPANY (US) 1996-09-19 WO claimed
US-5540997-A POLYMERS FOR ELECTROOPTICAL SWITCHES AND DISPLAY DEVIVES THE DOW CHEMICAL COMPANY (US) 1996-07-30 US claimed
US-7457508-B2 Polymeric compositions comprising quantum dots, optical devices comprising these compositions and methods for preparing same LUCENT TECHNOLOGIES INC. (US) 2008-11-25 US disclosed
US-20070217755-A1 Polymeric compositions comprising quantum dots,optical devices comprising these compositions and methods for preparing same LUCENT TECHNOLOGIES INC. (US) 2007-09-20 US disclosed
US-7197226-B2 Polymeric compositions comprising quantum dots, optical devices comprising these compositions and methods for preparing same LUCENT TECHNOLOGIES INC. (US) 2007-03-27 US disclosed
US-20060208223-A1 Polymeric compositions comprising quantum dots, optical devices comprising these compositions and methods for preparing same LUCENT TECHNOLOGIES INC. (US) 2006-09-21 US disclosed
WO-1996028755-A1 ALIGNMENT LAYER FOR A LIQUID CRYSTAL IN A LIQUID CRYSTAL DISPLAY DEVICE THE DOW CHEMICAL COMPANY (US) 1996-09-19 WO disclosed
US-5540997-A POLYMERS FOR ELECTROOPTICAL SWITCHES AND DISPLAY DEVIVES THE DOW CHEMICAL COMPANY (US) 1996-07-30 US disclosed