SCHEMBL9348455

SCHEMBL9348455

CCCCS(=O)(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 1/20 0.67
PARP14 Q460N5 2/20 0.54
MAPT P10636 4/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
EGFR P00533 2/20 0.54
MAPK1 P28482 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
PABPC1 P11940 1/20 0.54
RAB9A P51151 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
BRD4 O60885 2/20 0.50
MAOA P21397 1/20 0.49
MEN1 O00255 3/20 0.45
ALDH1A1 P00352 3/20 0.45
KMT2A Q03164 3/20 0.45
LMNA P02545 2/20 0.45
KDM4E B2RXH2 1/20 0.45
POLB P06746 2/20 0.44
RAD52 P43351 2/20 0.44
GAA P10253 1/20 0.44

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 0.94 PGAM1 (0.60) PGAM1PARP14MAPTSMN1; SMN2EGFR
SCHEMBL9348342 0.94 PGAM1 (0.60) PGAM1PARP14MAPTSMN1; SMN2EGFR
SCHEMBL9348365 0.91 MAPT (0.57) PGAM1PARP14MAPTSMN1; SMN2EGFR
SCHEMBL9348306 0.90 PGAM1 (0.54) PGAM1PARP14BRD4
SCHEMBL9348518 0.86 MAPT (0.62) PGAM1PARP14MAPTSMN1; SMN2EGFR
SCHEMBL9352466 0.86 PGAM1 (0.51) PGAM1PARP14BRD4
SCHEMBL9170501 0.84 PGAM1 (0.61) PGAM1BRD4
SCHEMBL9348354 0.83 PGAM1 (0.48) PGAM1PARP14BRD4
SCHEMBL9251868 0.82 MAPT (0.53) PGAM1MAPTSMN1; SMN2EGFRMAPK1
SCHEMBL9348345 0.82 PGAM1 (0.47) PGAM1PARP14BRD4

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