SCHEMBL20995296

SCHEMBL20995296

O=C(c1ccccc1)C(Br)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.61
CES1 P23141 4/20 0.61
GAA P10253 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ATM Q13315 1/20 0.51
GPR55 Q9Y2T6 1/20 0.51
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 1/20 0.47
NR4A1 P22736 1/20 0.47
SRD5A2 P31213 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PTGS2 P35354 2/20 0.44
CYP1B1 Q16678 1/20 0.44
MAOB P27338 1/20 0.44
GSK3B P49841 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL20995299 0.92 CES2 (0.54) CES2CES1MEN1KMT2AALOX15
SCHEMBL330776 0.87 TDP1 (0.56) CES2CES1GAAMEN1KMT2A
SCHEMBL20995293 0.82 CES2 (0.62) CES2CES1KMT2AALOX15TSHR
SCHEMBL627839 0.81 CES2 (0.53) CES2CES1GAAMEN1KMT2A
SCHEMBL4016467 0.81 CES2 (0.52) CES2CES1GAAMEN1KMT2A
SCHEMBL908908 0.80 CES2 (0.46) CES2CES1MEN1KMT2AALOX15
SCHEMBL2491977 0.80 CES2 (0.46) CES2CES1ALOX15TSHRL3MBTL1
SCHEMBL27493547 0.80 CES2 (0.61) CES2CES1GAAMEN1KMT2A
SCHEMBL3424507 0.79 GSK3B (0.61) CES2CES1MEN1KMT2AALOX15
SCHEMBL6181797 0.79 TDP1 (0.52) CES2CES1GAAMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11041119-B2 Europium beta-diketonate luminescent material Melman, Jonathan (US) 2021-06-22 US disclosed
US-20190161674-A1 EUROPIUM BETA-DIKETONATE LUMINESCENT MATERIAL MELMAN, JONATHAN 2019-05-30 US disclosed