SCHEMBL30838882

SCHEMBL30838882

CC1=NN(c2ccccc2)C(=O)C1=Cc1cccc(Br)c1

nearest known ligand 0.77

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 12/20 0.77
MEN1 O00255 8/20 0.77
GAA P10253 1/20 0.77
L3MBTL1 Q9Y468 8/20 0.63
POLB P06746 2/20 0.63
PSMD14 O00487 1/20 0.62
MAPT P10636 7/20 0.60
ALDH1A1 P00352 5/20 0.60
MAPK1 P28482 5/20 0.60
TDP1 Q9NUW8 4/20 0.60
KDM4E B2RXH2 3/20 0.60
LMNA P02545 2/20 0.60
HTT P42858 2/20 0.60
HPGD P15428 2/20 0.60
KAT8 Q9H7Z6 1/20 0.60
AMY1A P0DUB6 1/20 0.57
PKM P14618 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL28967926 1.00 KMT2A (0.77) KMT2AMEN1GAAL3MBTL1POLB
SCHEMBL28967922 1.00 KMT2A (0.77) KMT2AMEN1GAAL3MBTL1POLB
SCHEMBL29045640 0.92 KMT2A (0.69) KMT2AMEN1GAAL3MBTL1POLB
SCHEMBL29045637 0.92 KMT2A (0.69) KMT2AMEN1GAAL3MBTL1POLB
SCHEMBL245319 0.87 KMT2A (0.66) KMT2AMEN1GAAL3MBTL1POLB
SCHEMBL245318 0.87 KMT2A (0.66) KMT2AMEN1GAAL3MBTL1POLB
SCHEMBL29045647 0.87 KMT2A (1.00) KMT2AMEN1GAAL3MBTL1POLB
SCHEMBL29045646 0.87 KMT2A (1.00) KMT2AMEN1GAAL3MBTL1POLB
SCHEMBL10035997 0.86 KMT2A (0.81) KMT2AMEN1GAAL3MBTL1POLB
SCHEMBL28476008 0.86 KMT2A (0.81) KMT2AMEN1GAAL3MBTL1POLB

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-117820323-A Synthesis method of pyrazolone spiro-dihydropyrrole derivative 安徽工程大学 2024-04-05 CN disclosed