SCHEMBL8039451

SCHEMBL8039451

Nc1ccc(/C=C/c2ccc(N)c(-c3ccnnn3)c2S(=O)(=O)O)c(S(=O)(=O)O)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SENP2 Q9HC62 5/20 0.37
SENP1 Q9P0U3 5/20 0.37
SENP3 Q9H4L4 4/20 0.37
SUMO2 P61956 3/20 0.37
SUMO1 P63165 3/20 0.37
SENP7 Q9BQF6 3/20 0.37
RAD1 O60671 1/20 0.33
P2RY6 Q15077 1/20 0.33
NQO1 P15559 1/20 0.32
RAPGEF4 Q8WZA2 1/20 0.32
ENPP2 Q13822 1/20 0.31
ALDH1A1 P00352 2/20 0.30
RECQL P46063 2/20 0.30
KDM4E B2RXH2 1/20 0.30
NSD2 O96028 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
APEX1 P27695 1/20 0.30
APOBEC3A P31941 1/20 0.30

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
SCHEMBL8039469 1.00 SENP2 (0.37) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL4056348 0.90 SUMO2 (0.31) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL8038774 0.86 SUMO2 (0.31) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL8978053 0.83 SUMO2 (0.30) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL569801 0.75 SENP3 (0.32) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL170402 0.74 RAD1 (0.51) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL30616157 0.74 RAD1 (0.51) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL38871 0.74 RAD1 (0.51) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL38872 0.74 RAD1 (0.51) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL29397316 0.74 RAD1 (0.51) SENP2SENP1SENP3SUMO2SUMO1

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
WO-2000073391-A1 PROCESS FOR MAKING DYES OF HIGH PURITY BASF CORPORATION (US) 2000-12-07 WO claimed