SCHEMBL16424716

SCHEMBL16424716

c1ccc(N(c2cc(N(c3ccccc3)c3ccc4ccccc4c3)c3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)c2ccc3ccccc3c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.32

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
SCHEMBL16424731 0.92 ESR1 (0.33) PDK2
SCHEMBL16424823 0.92 ESR1 (0.33) PDK2
SCHEMBL14597170 0.91 PDK2 (0.35) PDK2
SCHEMBL16424892 0.90 — —
SCHEMBL16424711 0.89 PDK2 (0.34) PDK2
SCHEMBL16424720 0.89 PDK2 (0.32) PDK2
SCHEMBL23278345 0.88 PDK2 (0.33) PDK2
SCHEMBL23278358 0.88 PDK2 (0.33) PDK2
SCHEMBL23278425 0.88 PDK2 (0.33) PDK2
SCHEMBL24750472 0.88 PDK2 (0.33) PDK2

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-2015012618-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-01-29 — — WO disclosed
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