SCHEMBL28602736

SCHEMBL28602736

NC(=O)NN(c1ccccc1)c1ccccc1.[Hg]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 4/20 0.43
NPSR1 Q6W5P4 3/20 0.43
L3MBTL1 Q9Y468 3/20 0.41
RAB9A P51151 1/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
POLB P06746 2/20 0.40
GAA P10253 4/20 0.39
MAPT P10636 3/20 0.39
GFER P55789 1/20 0.39
CYP3A4 P08684 1/20 0.39
PARP1 P09874 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39

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
SCHEMBL2640797 0.98 KMT2A (0.48) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL28151420 0.96 KMT2A (0.47) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
Acetone SCHEMBL28488886 0.92 KMT2A (0.48) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
Alcohol SCHEMBL28831636 0.88 ALDH1A1 (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL11431150 0.84 ALDH1A1 (0.43) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL12305501 0.79 KMT2A (0.52) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL18305859 0.79 KMT2A (0.52) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL4581875 0.79 TSHR (0.40) KMT2ASMN1; SMN2ALDH1A1NPSR1L3MBTL1
SCHEMBL4581727 0.77 NPSR1 (0.41) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL135871 0.77 KMT2A (0.46) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1

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-113189028-A Serum chlorine detection reagent ball and serum chlorine detection chip 深圳市锦瑞生物科技有限公司 2021-07-30 CN disclosed