SCHEMBL8853391

SCHEMBL8853391

O=C(CCc1cccc2c1C(=O)NC2=O)OO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.42
▸ KDM4E B2RXH2 5/20 0.42
▸ GAA P10253 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ POLB P06746 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ GSK3B P49841 2/20 0.38
▸ GSK3A P49840 1/20 0.38
▸ CDK5 Q00535 1/20 0.38
▸ CDK5R1 Q15078 1/20 0.38
▸ CASP3 P42574 8/20 0.38
▸ RXFP1 Q9HBX9 2/20 0.37
▸ PARP1 P09874 1/20 0.35
▸ PDGFRB P09619 1/20 0.34
▸ CYP4F2 P78329 1/20 0.34
▸ CYP4A11 Q02928 1/20 0.34
▸ MAPK10 P53779 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL8853641 0.92 KDM4E (0.40) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL472072 0.89 KDM4E (0.39) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL8853253 0.85 KDM4E (0.44) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL2141218 0.83 PTGER1 (0.49) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL8693038 0.82 KDM4E (0.44) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL5970012 0.81 GSK3B (0.50) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL1424202 0.78 KDM4E (0.45) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL8853244 0.78 KDM4E (0.43) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL28287556 0.77 CYP4F2 (0.51) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL31474424 0.77 ALDH1A1 (0.49) ALDH1A1KDM4EGAAHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5575947-A BLEACH AUSIMONT S.R.L. (IT) 1996-11-19 — — US claimed
JP-9278747-A — — None — — JP disclosed
US-5688434-A BLEACHING TEXTILES BY APPLYING BLEACHING AGENT AUSIMONT S.P.A. (IT) 1997-11-18 — — US disclosed
JP-H09278747-A REDUCTION OF WATER AND POLAR IMPURITY IN IMIDE-ALKANE PERCARBOXYLIC ACID AUSIMONT SPA 1997-10-28 — — JP disclosed
US-5575947-A BLEACH AUSIMONT S.R.L. (IT) 1996-11-19 — — US disclosed
US-5520844-A Imide-aromatic peroxyacids as bleaching agents AUSIMONT S.P.A. (IT) 1996-05-28 — — US disclosed
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