SCHEMBL9348342

SCHEMBL9348342

CCCCCCCCCCCCCCCCS(=O)(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 1/20 0.60
EGFR P00533 1/20 0.51
MAPT P10636 1/20 0.51
PABPC1 P11940 1/20 0.51
MAPK1 P28482 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PARP14 Q460N5 1/20 0.49
ALOX5AP P20292 1/20 0.47
FEN1 P39748 1/20 0.47
MAOA P21397 1/20 0.47
BRD4 O60885 1/20 0.46

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
SCHEMBL9174066 1.00 PGAM1 (0.60) PGAM1EGFRMAPTPABPC1MAPK1
SCHEMBL9348306 0.96 PGAM1 (0.54) PGAM1PARP14BRD4
SCHEMBL9348455 0.94 PGAM1 (0.67) PGAM1EGFRMAPTPABPC1MAPK1
SCHEMBL9352466 0.92 PGAM1 (0.51) PGAM1PARP14BRD4
SCHEMBL9170501 0.90 PGAM1 (0.61) PGAM1ALOX5APFEN1BRD4
SCHEMBL9348365 0.89 MAPT (0.57) PGAM1EGFRMAPTPABPC1MAPK1
SCHEMBL9348354 0.88 PGAM1 (0.48) PGAM1PARP14BRD4
SCHEMBL9348345 0.87 PGAM1 (0.47) PGAM1PARP14ALOX5APFEN1BRD4
SCHEMBL13343626 0.86 PGAM1 (0.57) PGAM1ALOX5APFEN1BRD4
SCHEMBL9348518 0.84 MAPT (0.62) PGAM1EGFRMAPTPABPC1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0409638-B1 Anthraquinone dyes having alkylsulfonylamino substituents MINNESOTA MINING & MFG (US) 1994-08-31 EP claimed
EP-0409638-A1 Anthraquinone dyes having alkylsulfonylamino substituents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-01-23 EP claimed
EP-0409638-B1 Anthraquinone dyes having alkylsulfonylamino substituents MINNESOTA MINING & MFG (US) 1994-08-31 EP disclosed
US-5034547-A Colorfastness MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-07-23 US disclosed
EP-0409638-A1 Anthraquinone dyes having alkylsulfonylamino substituents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-01-23 EP disclosed