SCHEMBL29952008

SCHEMBL29952008

CNC(=O)c1cccc(OC2CC2)c1C=O

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 2/20 0.59
BAZ2B Q9UIF8 1/20 0.59
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PLK1 P53350 1/20 0.39
MRGPRX1 Q96LB2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
EPHX2 P34913 1/20 0.37
GAA P10253 1/20 0.37
HRH1 P35367 1/20 0.37
AXL P30530 1/20 0.37
TYRO3 Q06418 1/20 0.37
MERTK Q12866 1/20 0.37

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
SCHEMBL29955534 0.82 EPHX2 (0.43) KAT2BBAZ2BALDH1A1MRGPRX1EPHX2
SCHEMBL29954020 0.81 MKNK1 (0.42) KAT2BBAZ2BMRGPRX1HRH1
SCHEMBL15629186 0.80 KAT2B (0.62) KAT2BBAZ2BALDH1A1LMNAMEN1
SCHEMBL29952725 0.80 KAT2B (0.45) KAT2BBAZ2BALDH1A1LMNAL3MBTL1
SCHEMBL29953356 0.79 KAT2B (0.50) KAT2BBAZ2BHRH1
SCHEMBL29953161 0.79 KAT2B (0.50) KAT2BBAZ2BPLK1GAA
SCHEMBL29956373 0.77 KAT2B (0.38) KAT2BBAZ2BALDH1A1MEN1KMT2A
SCHEMBL29956100 0.76 KAT2B (0.50) KAT2BBAZ2BALDH1A1PLK1
SCHEMBL29955013 0.76 SCD (0.41) KAT2BBAZ2BAXLMERTK
SCHEMBL29957292 0.75 KAT2B (0.52) KAT2BBAZ2BALDH1A1

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed