SCHEMBL28025439

SCHEMBL28025439

Cc1cc(C)c(C)c(C2=C[CH]c3ccccc32)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
MAPK1 P28482 1/20 0.32
RAPGEF4 Q8WZA2 3/20 0.32
ELANE P08246 1/20 0.32
POLB P06746 1/20 0.31
TTR P02766 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL28025456 0.84 KDM4E (0.30) CYP1A2
SCHEMBL28025448 0.82 PDK2 (0.37) PDK2CYP1A2CYP2A6MAPK1RAPGEF4
SCHEMBL28512609 0.81 ELANE (0.40) PDK2CYP1A2CYP2A6MAPK1ELANE
SCHEMBL28506789 0.81 ELANE (0.40) PDK2CYP2A6MAPK1RAPGEF4ELANE
SCHEMBL28521495 0.80 TRPA1 (0.34) CYP1A2CYP2A6RAPGEF4ALDH1A1
SCHEMBL28025947 0.79 ACHE (0.35) CYP1A2MAPK1POLBALDH1A1L3MBTL1
SCHEMBL28025490 0.79 CYP1A2 (0.34) CYP1A2ELANE
SCHEMBL28515390 0.77 NPC1 (0.38) ALDH1A1
SCHEMBL28025999 0.77 MEN1 (0.33) ELANEALDH1A1
SCHEMBL28025423 0.77 BRD9 (0.34) ELANETTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109824802-A Metallocenic compound, catalyst system and the polymerization using them of bridging 埃克森美孚化学专利公司 2019-05-31 CN claimed
CN-108137729-B Catalysts for forming multimodal polymers 埃克森美孚化学专利公司 2021-02-05 CN disclosed
CN-109824802-A Metallocenic compound, catalyst system and the polymerization using them of bridging 埃克森美孚化学专利公司 2019-05-31 CN disclosed
CN-108137729-A It is used to form the catalyst of multimodal polymer 埃克森美孚化学专利公司 2018-06-08 CN disclosed
CN-104822697-A Bridged metallocene compounds, catalyst systems and polymerization processes using the same EXXONMOBIL CHEM PATENTS INC 2015-08-05 CN disclosed