SCHEMBL16358513

SCHEMBL16358513

CCC1(CC)c2cc(CO)ccc2-c2ccc(-c3ccc([Si](C)(C)C)cc3)cc21

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 12/20 0.44
▸ KIF11 P52732 1/20 0.33
▸ S1PR1 P21453 1/20 0.32
▸ S1PR3 Q99500 1/20 0.32
▸ CHEK1 O14757 1/20 0.32
▸ PRKCI P41743 1/20 0.32
▸ CNR1 P21554 3/20 0.31
▸ CNR2 P34972 3/20 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
SCHEMBL16358953 0.82 PDK2 (0.36) PDK2S1PR1S1PR3
SCHEMBL16358511 0.81 PDK2 (0.33) PDK2
SCHEMBL16358514 0.79 PDK2 (0.41) PDK2KIF11
SCHEMBL16358515 0.78 CCNT1 (0.34) PDK2
SCHEMBL16358498 0.75 PDK2 (0.38) PDK2
SCHEMBL12213232 0.74 PGR (0.30) —
SCHEMBL16358899 0.74 PDK2 (0.34) PDK2
SCHEMBL5387522 0.73 PDK2 (0.47) PDK2
SCHEMBL9779433 0.72 PDK2 (0.38) PDK2
SCHEMBL28015675 0.71 PDK2 (0.48) PDK2KIF11PRKCI

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
WO-2010140801-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME DOW ADVANCED DISPLAY MATERIALS, LTD. (KR) 2010-12-09 — — WO disclosed
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