SCHEMBL28026570

SCHEMBL28026570

CC(C)C(C)C(=O)OC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
MAPK1 P28482 1/20 0.48
HIF1A Q16665 1/20 0.48
LMNA P02545 3/20 0.48
F2 P00734 1/20 0.48
ALDH1A1 P00352 3/20 0.47
TDP1 Q9NUW8 4/20 0.46
TP53 P04637 1/20 0.46
ADRB2 P07550 1/20 0.45
ADRB1 P08588 1/20 0.45
ADRB3 P13945 1/20 0.45
PDCD1 Q15116 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL2729575 0.84 TSHR (0.54) TSHRMAPK1HIF1ALMNAF2
SCHEMBL582408 0.82 ALDH1A1 (0.53) TSHRMAPK1HIF1ALMNAF2
SCHEMBL6483048 0.81 TSHR (0.47) TSHRMAPK1HIF1ALMNAF2
SCHEMBL6483049 0.81 TSHR (0.47) TSHRMAPK1HIF1ALMNAF2
SCHEMBL1532124 0.81 TSHR (0.50) TSHRMAPK1HIF1ALMNAF2
SCHEMBL13889265 0.81 TSHR (0.50) TSHRMAPK1HIF1ALMNAF2
SCHEMBL27642229 0.81 TSHR (0.50) TSHRMAPK1HIF1ALMNAF2
SCHEMBL28013511 0.79 TSHR (0.58) TSHRMAPK1HIF1ALMNAF2
SCHEMBL28015627 0.79 TSHR (0.48) TSHRMAPK1HIF1ALMNAF2
SCHEMBL27312808 0.79 PTGS1 (0.51) TSHRMAPK1HIF1ALMNAF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109415553-A The thermosetting resin of plasticising and related solidified resin, curing method and the product comprising solidified resin 马萨诸塞大学 2019-03-01 CN claimed
CN-104828806-B A graphene modifier, a graphene reinforced composite material and a preparing method of the graphene reinforced composite material 东莞劲胜精密组件股份有限公司 2017-01-11 CN claimed
CN-104828806-A A graphene modifier, a graphene reinforced composite material and a preparing method of the graphene reinforced composite material JANUS DONGGUAN PREC COMPONENTS 2015-08-12 CN claimed
CN-109415553-A The thermosetting resin of plasticising and related solidified resin, curing method and the product comprising solidified resin 马萨诸塞大学 2019-03-01 CN disclosed
CN-104828806-B A graphene modifier, a graphene reinforced composite material and a preparing method of the graphene reinforced composite material 东莞劲胜精密组件股份有限公司 2017-01-11 CN disclosed
CN-104828806-A A graphene modifier, a graphene reinforced composite material and a preparing method of the graphene reinforced composite material JANUS DONGGUAN PREC COMPONENTS 2015-08-12 CN disclosed