SCHEMBL1153546

SCHEMBL1153546

C=C(C)C(=O)OCc1cccc(Br)c1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
RAB9A P51151 2/20 0.41
POLB P06746 2/20 0.41
KMT2A Q03164 2/20 0.41
PKM P14618 1/20 0.41
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP12 P39900 1/20 0.40
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
TSHR P16473 3/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 4/20 0.35
PPARG P37231 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
THRB P10828 1/20 0.34
LMNA P02545 1/20 0.33

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
SCHEMBL3290961 0.87 MAPT (0.52) MAPTRAB9APOLBKMT2APKM
SCHEMBL11163982 0.86 TSHR (0.37) MAPTRAB9APOLBKMT2APKM
SCHEMBL607429 0.83 ALDH1A1 (0.47) MAPTRAB9APOLBKMT2APKM
SCHEMBL29577269 0.81 TSHR (0.44) MAPTRAB9APOLBKMT2APKM
SCHEMBL4202389 0.81 TSHR (0.44) MAPTRAB9APOLBKMT2APKM
SCHEMBL28795747 0.78 ALDH1A1 (0.44) MAPTRAB9APOLBKMT2APKM
Pentachlorophenol SCHEMBL21258145 0.77 MAPT (0.44) MAPTRAB9APOLBKMT2APKM
SCHEMBL1372181 0.77 THRB (0.42) MAPTRAB9APOLBKMT2APKM
SCHEMBL31707533 0.77 ALDH1A1 (0.52) MAPTPOLBTSHRALDH1A1APEX1
SCHEMBL8988143 0.76 IAPP (0.50) GABRA1GABRB2TSHRTHRB

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-20110045285-A1 TRANSPARENT CONDUCTIVE FILM FUJIFILM CORPORATION (JP) 2011-02-24 US disclosed
US-4369298-A Novel cured resin, process for production thereof, and lens composed of said resin from bis(alkyleneoxyphenyl)-diacrylate, bis(alkyleneoxyphenyl)diallyl ether, bis(alkyleneoxyphenyl)diallyl carbonate monomers TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1983-01-18 US disclosed