SCHEMBL4453436

SCHEMBL4453436

CSNC(=O)N/N=C/c1ccc(-c2ccc(Cl)c(Cl)c2)o1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.70
KMT2A Q03164 5/20 0.70
MEN1 O00255 2/20 0.70
MAPT P10636 9/20 0.63
ALDH1A1 P00352 6/20 0.63
NPSR1 Q6W5P4 2/20 0.63
HTT P42858 1/20 0.63
POLB P06746 3/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
MAPK1 P28482 1/20 0.59
BLM P54132 1/20 0.59
KDM4E B2RXH2 5/20 0.58
KEAP1 Q14145 1/20 0.52
NFE2L2 Q16236 1/20 0.52
PHGDH O43175 2/20 0.52
CA1 P00915 1/20 0.51
LMNA P02545 2/20 0.51
PRMT5 O14744 1/20 0.51
WDR77 Q9BQA1 1/20 0.51
SAE1 Q9UBE0 1/20 0.51

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
SCHEMBL4455852 0.88 HPGD (0.66) HPGDKMT2AMEN1MAPTALDH1A1
SCHEMBL4462856 0.87 PRMT5 (0.67) HPGDKMT2AMEN1MAPTALDH1A1
SCHEMBL4459309 0.82 KEAP1 (0.61) HPGDKMT2AMEN1MAPTALDH1A1
SCHEMBL4457834 0.81 MAPT (0.69) HPGDKMT2AMEN1MAPTALDH1A1
SCHEMBL4332717 0.79 MAPT (0.49) HPGDKMT2AMEN1MAPTALDH1A1
SCHEMBL4331124 0.78 KDM4E (0.72) HPGDKMT2AMEN1MAPTALDH1A1
SCHEMBL12417179 0.78 MAPT (0.69) HPGDKMT2AMEN1MAPTALDH1A1
SCHEMBL4453439 0.78 KMT2A (0.74) HPGDKMT2AMEN1MAPTALDH1A1
SCHEMBL13887126 0.78 KMT2A (0.74) HPGDKMT2AMEN1MAPTALDH1A1
SCHEMBL4326729 0.77 MEN1 (1.00) HPGDKMT2AMEN1MAPTALDH1A1

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-7521062-B2 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-04-21 US disclosed