SCHEMBL7573934

SCHEMBL7573934

CC(=O)CN(CC(C)=O)C(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.56
ALDH1A1 P00352 2/20 0.56
MAPT P10636 1/20 0.52
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
EGFR P00533 2/20 0.47
CTSL P07711 1/20 0.46
CTSS P25774 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
HDAC1 Q13547 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
HDAC3 O15379 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
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
SCHEMBL21821613 0.87 ALDH1A1 (0.49) HPGDALDH1A1MAPTKMT2AMEN1
SCHEMBL11077650 0.86 EGFR (0.55) HPGDALDH1A1MAPTKMT2AMEN1
SCHEMBL9474547 0.84 TSHR (0.49) HPGDALDH1A1MAPTKMT2AMEN1
SCHEMBL2226134 0.83 HPGD (0.55) HPGDALDH1A1MAPTKMT2AMEN1
SCHEMBL13337842 0.82 KMT2A (0.51) HPGDALDH1A1KMT2AMEN1EGFR
SCHEMBL72112 0.78 HPGD (0.85) HPGDALDH1A1MAPTL3MBTL1HDAC1
SCHEMBL29172972 0.77 HPGD (0.64) HPGDALDH1A1MAPTKMT2AMEN1
Hydrochloric Acid SCHEMBL6612619 0.77 HPGD (0.81) HPGDALDH1A1MAPTL3MBTL1HDAC1
Hydrochloric Acid SCHEMBL8527466 0.77 HPGD (0.81) HPGDALDH1A1MAPTL3MBTL1HDAC1
Fluoride SCHEMBL28693456 0.77 HPGD (0.81) HPGDALDH1A1MAPTL3MBTL1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3572408-A1 METHOD FOR PURIFYING AN AMINO ACID-N-CARBOXY ANHYDRIDE Shin-Etsu Chemical Co., Ltd. (JP) 2019-11-27 EP disclosed
EP-0816328-B1 Process for the manufacture of acetonylbenzamides DOW AGROSCIENCES LLC (US) 2002-03-27 EP disclosed
EP-0816328-A3 Process for the manufacture of acetonylbenzamides ROHM AND HAAS COMPANY (US) 2000-11-02 EP disclosed