SCHEMBL28403249

SCHEMBL28403249

O=Cc1ccccc1-c1ccoc2cccc1-2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ERN1 O75460 6/20 0.38
ALDH1A1 P00352 3/20 0.35
TSHR P16473 1/20 0.35
TRIM24 O15164 1/20 0.35
TRIM33 Q9UPN9 1/20 0.35
PTPRC P08575 1/20 0.35
KCNN4 O15554 1/20 0.35
XDH P47989 1/20 0.33
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PTPN1 P18031 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 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
SCHEMBL610633 0.83 ERN1 (0.49) LMNAKMT2AMEN1THRBBLM
SCHEMBL31588841 0.78 KMT2A (0.67) LMNAKMT2AMEN1THRBBLM
SCHEMBL27511393 0.78 KMT2A (0.67) LMNAKMT2AMEN1THRBBLM
SCHEMBL249552 0.76 KMT2A (0.71) LMNAKMT2AMEN1THRBBLM
SCHEMBL31175932 0.76 KMT2A (0.71) LMNAKMT2AMEN1THRBBLM
SCHEMBL28229774 0.74 PTPN1 (0.45) LMNAKMT2AMEN1THRBBLM
SCHEMBL97156 0.73 ERN1 (0.46) LMNAKMT2AMEN1THRBBLM
SCHEMBL3665852 0.69 KMT2A (0.64) LMNAKMT2AMEN1ERN1ALDH1A1
Benzene SCHEMBL28725386 0.69 LMNA (0.52) LMNAKMT2AMEN1THRBBLM
SCHEMBL29506697 0.69 LMNA (0.52) LMNAKMT2AMEN1THRBBLM

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
CN-108191859-B Aza-aromatic compound used as blue fluorescent material and application thereof 烟台显华光电材料研究院有限公司 2020-06-09 CN disclosed