SCHEMBL11043861

SCHEMBL11043861

O=C1c2ccccc2C(=O)[N+]1(c1ccccc1)S(=O)(=O)[N+]1(c2ccccc2)C(=O)c2ccccc2C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 4/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 5/20 0.39
HTT P42858 3/20 0.39
LMNA P02545 3/20 0.39
KDM4E B2RXH2 3/20 0.39
MAOA P21397 3/20 0.39
APAF1 O14727 2/20 0.39
TDP2 O95551 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
POLB P06746 2/20 0.39
CES1 P23141 2/20 0.39
S100A4 P26447 2/20 0.39
RAB9A P51151 2/20 0.39
BLM P54132 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CES2 O00748 1/20 0.39
TERT O14746 1/20 0.39
NPC1 O15118 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
SCHEMBL10455528 0.76 HTR6 (0.33) CDC25BKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL9717994 0.72 MEN1 (0.41) CDC25BKMT2AMEN1MAPTHTT
SCHEMBL8651236 0.64 MEN1 (0.39) CDC25BKMT2AMEN1MAPTHTT
SCHEMBL11901035 0.62 MEN1 (0.42) CDC25BKMT2AMEN1MAPTHTT
Anthraquinone SCHEMBL183074 0.61 MEN1 (0.86) CDC25BKMT2AMEN1MAPTHTT
SCHEMBL10321305 0.61 CDC25B (0.45) CDC25BKMT2AMEN1MAPTHTT
Anthraquinone SCHEMBL1901249 0.60 MEN1 (1.00) CDC25BKMT2AMEN1MAPTHTT
Anthraquinone SCHEMBL14943 0.60 MEN1 (1.00) CDC25BKMT2AMEN1MAPTHTT
Anthraquinone SCHEMBL29358690 0.60 MEN1 (1.00) CDC25BKMT2AMEN1MAPTHTT
SCHEMBL5497788 0.59 MAPT (0.65) CDC25BKMT2AMEN1MAPTHTT

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
EP-0029930-B1 USE OF POLYETHYLENE TEREPHTHALATE MOULDING MASSES CONTAINING AN ORGANIC IMIDE IN THE PREPARATION OF CRYSTALLINE MOULDINGS BY INJECTION MOULDING AT LOW MOULD TEMPERATURES BAYER AG (DE) 1984-02-15 EP disclosed
EP-0029930-A1 Use of polyethylene terephthalate moulding masses containing an organic imide in the preparation of crystalline mouldings by injection moulding at low mould temperatures BAYER AG (DE) 1981-06-10 EP disclosed