SCHEMBL6205255

SCHEMBL6205255

O=C(O)/C(O)=C\C(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.59
MEN1 O00255 3/20 0.59
LMNA P02545 1/20 0.55
POLB P06746 2/20 0.50
LNPEP Q9UIQ6 1/20 0.48
MAPT P10636 2/20 0.47
PGR P06401 1/20 0.47
PFKFB3 Q16875 1/20 0.47
WDR5 P61964 2/20 0.46
HDAC1 Q13547 2/20 0.46
HDAC8 Q9BY41 2/20 0.46
ITGA1 P56199 2/20 0.46
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45

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
SCHEMBL6205259 1.00 KMT2A (0.59) KMT2AMEN1LMNAPOLBLNPEP
SCHEMBL6205252 1.00 KMT2A (0.59) KMT2AMEN1LMNAPOLBLNPEP
SCHEMBL6206304 0.90 MEN1 (0.53) KMT2AMEN1LMNAPOLBMAPT
SCHEMBL6206246 0.90 MEN1 (0.53) KMT2AMEN1LMNAPOLBMAPT
SCHEMBL6204582 0.90 MEN1 (0.53) KMT2AMEN1LMNAPOLBMAPT
SCHEMBL6205747 0.90 MEN1 (0.53) KMT2AMEN1LMNAPOLBMAPT
SCHEMBL6206300 0.90 MEN1 (0.53) KMT2AMEN1LMNAPOLBMAPT
SCHEMBL6206251 0.90 MEN1 (0.53) KMT2AMEN1LMNAPOLBMAPT
SCHEMBL6205161 0.87 KMT2A (0.53) KMT2AMEN1LMNAPOLBMAPT
SCHEMBL6205157 0.87 KMT2A (0.53) KMT2AMEN1LMNAPOLBMAPT

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
EP-1100763-B1 DIKETOACID-DERIVATIVES AS INHIBITORS OF POLYMERASES ANGELETTI P IST RICHERCHE BIO (IT) 2005-06-22 EP claimed