SCHEMBL28040802

SCHEMBL28040802

Cc1c(C)c(C)c([SiH2]c2ccccc2)c(C)c1C

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ACHE P22303 2/20 0.36
LMNA P02545 1/20 0.36
ALOX12 P18054 1/20 0.36
AHR P35869 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
SCHEMBL988389 0.83 KDM4E (0.34) TSHRACHELMNAALOX12
Ethylene SCHEMBL29078356 0.80 TSHR (0.39) TSHRACHELMNAALOX12
SCHEMBL52125 0.80 TSHR (0.44) TSHRACHELMNAALOX12
SCHEMBL988673 0.78 TSHR (0.37) TSHRACHELMNAALOX12
Chloromethane SCHEMBL28762557 0.77 TSHR (0.44) TSHRACHELMNAALOX12
SCHEMBL2058065 0.77 POLB (0.38) TSHR
SCHEMBL3133054 0.76 TSHR (0.41) TSHRACHELMNAALOX12
Fluoride SCHEMBL704196 0.76 TSHR (0.41) TSHRACHELMNAALOX12
Hydrochloric Acid SCHEMBL15122374 0.76 TSHR (0.41) TSHRACHELMNAALOX12
SCHEMBL2793385 0.76 TSHR (0.41) TSHRACHELMNAALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102666561-B Transition metal complex, the cyclopentadiene compound of catalyst for trimerization and replacement SUMITOMO CHEMICAL CO.,LTD. (JP) 2015-11-25 CN disclosed