SCHEMBL13158751

SCHEMBL13158751

CC1(C)c2cc(-c3c4ccccc4c(-c4ccc(-c5c6ccccc6c(-c6ccccc6)c6cc(-c7ccccc7)ccc56)cc4)c4ccccc34)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.33
▸ TSPO P30536 1/20 0.31
▸ ACHE P22303 2/20 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
SCHEMBL10175745 0.98 PDK2 (0.32) PDK2ACHE
SCHEMBL10160256 0.98 PDK2 (0.32) PDK2ACHE
SCHEMBL9963808 0.98 PDK2 (0.32) PDK2ACHE
SCHEMBL2613516 0.94 PDK2 (0.35) PDK2ACHE
SCHEMBL2613536 0.94 PDK2 (0.35) PDK2ACHE
SCHEMBL9963831 0.94 PDK2 (0.35) PDK2ACHE
SCHEMBL10153157 0.94 ACHE (0.33) PDK2ACHE
SCHEMBL10064008 0.94 ACHE (0.33) PDK2ACHE
SCHEMBL12873451 0.93 PDK2 (0.31) PDK2
SCHEMBL9963832 0.93 PDK2 (0.36) PDK2ACHE

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-2010114263-A2 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME DOW ADVANCED DISPLAY MATERIALS,LTD. (KR) 2010-10-07 — — WO disclosed
Send feedback