SCHEMBL17751346

SCHEMBL17751346

CCN(CCN=O)C1=CC(=O)C(C)=CC1=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.33
▸ EEF2K O00418 1/20 0.31
▸ PLK1 P53350 1/20 0.31
▸ PLK2 Q9NYY3 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
SCHEMBL17751334 0.80 STAT3 (0.34) STAT3EEF2KPLK1PLK2
SCHEMBL17751379 0.76 STAT3 (0.32) STAT3EEF2KPLK1PLK2
SCHEMBL17751366 0.72 DNM1 (0.36) —
SCHEMBL21814508 0.72 ALDH1A1 (0.34) —
SCHEMBL17751344 0.64 EEF2K (0.43) STAT3EEF2KPLK1PLK2
SCHEMBL21814514 0.64 HCAR3 (0.35) —
SCHEMBL8958484 0.64 ALDH1A1 (0.34) —
P-Xyloquinone SCHEMBL49964 0.62 PLK1 (0.60) STAT3EEF2KPLK1PLK2
SCHEMBL15920407 0.61 ALDH1A1 (0.62) —
SCHEMBL21819284 0.59 ACHE (0.40) —

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-2791106-B1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEROF OREAL (FR) 2016-05-18 — — EP disclosed
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