SCHEMBL8414583

SCHEMBL8414583

CC(C)(C)c1cccc(C(C)(C)OOC(C)(C)c2cccc(C(C)(C)C)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.58
HDAC8 Q9BY41 2/20 0.45
HDAC4 P56524 1/20 0.45
HDAC2 Q92769 1/20 0.45
KIF11 P52732 2/20 0.44
ACHE P22303 3/20 0.41
RXRA P19793 2/20 0.39
RXRB P28702 2/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 4/20 0.38
ALOX15 P16050 2/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRB2 P47870 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
SCHEMBL10346259 0.94 MAPK1 (0.71) MAPK1HDAC8HDAC4HDAC2KIF11
SCHEMBL44643 0.86 MAPK1 (0.58) MAPK1HDAC8HDAC4HDAC2KIF11
SCHEMBL2865735 0.86 MAPK1 (0.81) MAPK1ESR1ESR2CYP3A4ALDH1A1
SCHEMBL129151 0.84 HDAC8 (0.56) HDAC8HDAC4HDAC2KIF11ACHE
SCHEMBL31578994 0.84 MAPK1 (0.56) MAPK1HDAC8HDAC4HDAC2KIF11
SCHEMBL12500725 0.84 HDAC8 (0.44) MAPK1HDAC8HDAC4HDAC2KIF11
Methoxymethane SCHEMBL28022475 0.82 HDAC8 (0.50) MAPK1HDAC8HDAC4HDAC2KIF11
Hydrogen Peroxide SCHEMBL20240069 0.82 MAPK1 (0.60) MAPK1HDAC8HDAC4HDAC2RXRA
SCHEMBL19327212 0.82 MAPK1 (0.60) MAPK1HDAC8HDAC4HDAC2ESR1
Water SCHEMBL29289408 0.82 HDAC8 (0.54) HDAC8HDAC4HDAC2KIF11ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0613154-B1 Process for preparing a polyethylene composition for use in insulations and joints of extra-high voltage power cables FUJIKURA LTD (JP) 1999-08-18 EP disclosed
EP-0613154-A2 Polyethylene composition for use in insulations and joints of extra-high voltage power cables, and an extra-high voltage power cable and joint therefor employing this polyethylene composition FUJIKURA LTD. (JP) 1994-08-31 EP disclosed
US-4134927-A EXTRUDING ETHYLENE COPOLYMER, UNSATURATED DICARBOXYLIC ACID, AND AN ALKYL PEROXIDE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1979-01-16 US disclosed