SCHEMBL18399472

SCHEMBL18399472

CC(C)(c1ccc(C(C)(O)C(F)(F)F)c(O)c1)c1ccc(O)c(C(C)(O)C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.46
HSP90AA1 P07900 1/20 0.42
KLF10 Q13118 1/20 0.41
ALOX15 P16050 4/20 0.39
ALOX12 P18054 1/20 0.39
HSD17B10 Q99714 4/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
RORC P51449 1/20 0.38
NR1I2 O75469 1/20 0.38
LMNA P02545 1/20 0.38
CYP2C9 P11712 1/20 0.38
MIF P14174 1/20 0.38
TYR P14679 1/20 0.38
HTT P42858 1/20 0.38
NFE2L2 Q16236 1/20 0.38
AR P10275 5/20 0.36
ESR2 Q92731 2/20 0.36
TSHR P16473 2/20 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
SCHEMBL18399450 0.93 ESR1 (0.52) ESR1HSP90AA1KLF10ALOX15ALOX12
SCHEMBL18399454 0.92 ESR1 (0.50) ESR1HSP90AA1KLF10ALOX15ALOX12
SCHEMBL18399461 0.87 ESR1 (0.52) ESR1HSP90AA1KLF10ALOX15ALOX12
SCHEMBL18399442 0.87 ESR1 (0.52) ESR1HSP90AA1KLF10ALOX15ALOX12
SCHEMBL18399456 0.87 ESR1 (0.51) ESR1HSP90AA1KLF10ALOX15ALOX12
SCHEMBL18399466 0.87 ESR1 (0.52) ESR1KLF10ALOX15ALOX12HSD17B10
SCHEMBL18399470 0.84 ESR1 (0.49) ESR1HSP90AA1KLF10ALOX15ALOX12
SCHEMBL18400662 0.84 ESR1 (0.46) ESR1KLF10ALOX15ALOX12HSD17B10
SCHEMBL18399465 0.82 ESR1 (0.63) ESR1HSP90AA1KLF10ALOX15ALOX12
SCHEMBL18399455 0.81 ALDH1A1 (0.46) ESR1HSP90AA1KLF10ALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170088666-A1 Fluorine-Containing Polymerizable Monomer and Polymer Compound Using Same CENTRAL GLASS COMPANY, LIMITED (JP) 2017-03-30 US disclosed
US-9550711-B2 Fluorine-containing polymerizable monomer and polymer compound using same CENTRAL GLASS COMPANY, LIMITED (JP) 2017-01-24 US disclosed