SCHEMBL18517952

SCHEMBL18517952

C=C(/C=C\C=C/C)[C@@]1(c2ccccc2)c2cc(-c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccccc3-c3ccccc3)cc21

nearest known ligand 0.32

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
SCHEMBL19543811 0.96 PDK2 (0.30) PDK2
SCHEMBL16926121 0.95 — —
SCHEMBL19543838 0.94 PDK2 (0.31) PDK2
SCHEMBL18518104 0.90 PDK2 (0.31) PDK2
SCHEMBL18518253 0.90 PDK2 (0.32) PDK2
SCHEMBL19545016 0.90 PDK2 (0.37) PDK2
SCHEMBL24377934 0.89 — —
SCHEMBL16856341 0.89 PDK2 (0.31) PDK2
SCHEMBL16926124 0.86 PDK2 (0.30) PDK2
SCHEMBL19607668 0.86 — —

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
EP-2875699-B1 DERIVATES OF 2-DIARYLAMINOFLUOREN AND ORGANIC ELECTRONIC DEVICES COMPRISING THE SAME MERCK PATENT GMBH (DE) 2017-02-15 — — EP disclosed
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