SCHEMBL20169150

SCHEMBL20169150

N#CC(C#N)=C1c2cc(F)ccc2-c2cc3cc4nc5c(nc4cc3nc21)C(=C(C#N)C#N)c1cc(F)ccc1-5

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP8 P40818 1/20 0.39
USP7 Q93009 1/20 0.39
USP47 Q96K76 1/20 0.39
KDM4E B2RXH2 1/20 0.34
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL20169152 1.00 USP8 (0.39) USP8USP7USP47KDM4EMAPT
SCHEMBL2756397 0.91 USP7 (0.46) USP8USP7USP47KDM4EMAPT
SCHEMBL2756406 0.91 USP7 (0.46) USP8USP7USP47KDM4EMAPT
SCHEMBL2755926 0.88 USP8 (0.43) USP8USP7USP47KDM4EMAPT
SCHEMBL1755061 0.85 USP8 (0.42) USP8USP7USP47KDM4EMAPT
SCHEMBL20169148 0.84 KDM4E (0.38) KDM4EMAPTALDH1A1GAAPKM
SCHEMBL20169151 0.84 SMN1; SMN2 (0.34) USP8USP7USP47KDM4EMAPT
SCHEMBL2756329 0.84 USP7 (0.49) USP8USP7USP47KDM4EMAPT
SCHEMBL24872866 0.83 USP7 (0.45) USP8USP7USP47KDM4EMAPT
SCHEMBL12149135 0.80 USP8 (0.38) USP8USP7USP47MAPTALDH1A1

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
US-9978975-B2 Organic electroluminescence device JOLED INC (JP) 2018-05-22 US disclosed