SCHEMBL28520567

SCHEMBL28520567

C=CC(=O)Oc1cccc(N=NS(=O)(=O)O)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
CYP1A2 P05177 1/20 0.39
KMT2A Q03164 5/20 0.34
MEN1 O00255 4/20 0.34
THRB P10828 4/20 0.34
ACHE P22303 3/20 0.34
EGFR P00533 2/20 0.33
THRA P10827 1/20 0.32
CYP3A4 P08684 2/20 0.31
LMNA P02545 1/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 1/20 0.31
TYMS P04818 1/20 0.31
POLB P06746 1/20 0.31
BLM P54132 1/20 0.31
MCL1 Q07820 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 2/20 0.30
MAPK1 P28482 2/20 0.30
TDP1 Q9NUW8 2/20 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
SCHEMBL14689871 0.86 KMT2A (0.41) ALDH1A1KMT2AMEN1THRBACHE
SCHEMBL14689870 0.86 KMT2A (0.41) ALDH1A1KMT2AMEN1THRBACHE
SCHEMBL23270848 0.82 POLB (0.53) KMT2APOLBMAPTMAPK1TDP1
SCHEMBL14431098 0.79 HCAR2 (0.44) ALDH1A1CYP1A2THRBLMNAMAPT
SCHEMBL633251 0.78 KMT2A (0.37) ALDH1A1KMT2AMEN1THRBACHE
SCHEMBL20183951 0.77 MIF (0.39) ALDH1A1CYP1A2KMT2AMEN1THRB
SCHEMBL421454 0.76 KMT2A (0.56) ALDH1A1KMT2AMEN1THRBACHE
SCHEMBL9579704 0.75 LMNA (0.40) ALDH1A1KMT2AMEN1THRBCYP3A4
SCHEMBL9489908 0.74 TDP1 (0.39) ALDH1A1CYP1A2POLBMCL1TDP1
SCHEMBL14431279 0.74 TDP1 (0.39) ALDH1A1CYP1A2POLBMCL1TDP1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112352017-B Aqueous resin composition and method for producing same DIC株式会社 2023-04-07 CN disclosed
CN-112352017-A Aqueous resin composition and method for producing same DIC株式会社 2021-02-09 CN disclosed