SCHEMBL28040856

SCHEMBL28040856

CC(C)(C)C1=C[C]([Si](c2cc(C(C)(C)C)cc(C(C)(C)C)c2)(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)c2cc(C(C)(C)C)cc(C(C)(C)C)c2)C=C1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL28040811 0.81 GABRA1 (0.34) GABRA1GABRB2KDM4EGAAMAPT
SCHEMBL28040361 0.77
SCHEMBL28040415 0.77 HSPA5 (0.30)
SCHEMBL28040436 0.77 GABRA1 (0.31) GABRA1GABRB2
SCHEMBL28040390 0.76
SCHEMBL28040804 0.75
Methylamine SCHEMBL28040471 0.73 GABRA1 (0.37) GABRA1GABRB2KDM4EGAAMAPT
SCHEMBL28040884 0.73
SCHEMBL28040786 0.73
SCHEMBL93161 0.64 GABRA1 (0.69) GABRA1GABRB2KDM4EGAAMAPT

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