SCHEMBL6553748

SCHEMBL6553748

C=CCN1C(=O)NC(=O)C1O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.37
ALDH1A1 P00352 3/20 0.34
MAPT P10636 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GLA P06280 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL20187930 0.76 MAPT (0.40) CYP3A4ALDH1A1MAPTL3MBTL1MEN1
SCHEMBL20187928 0.76 MAPT (0.40) CYP3A4ALDH1A1MAPTL3MBTL1MEN1
SCHEMBL20188285 0.76 MAPT (0.40) CYP3A4ALDH1A1MAPTL3MBTL1MEN1
SCHEMBL25406721 0.76 CYP3A4 (0.37) CYP3A4ALDH1A1MAPTL3MBTL1MEN1
SCHEMBL22644821 0.73 MAPT (0.38) CYP3A4ALDH1A1MAPTL3MBTL1MEN1
SCHEMBL8026282 0.70 CYP3A4 (0.42) CYP3A4ALDH1A1MAPTL3MBTL1KMT2A
SCHEMBL6233396 0.69 KDM4E (0.36) ALDH1A1POLBKDM4E
SCHEMBL8774567 0.68 CYP3A4 (0.37) CYP3A4ALDH1A1MAPTL3MBTL1MEN1
SCHEMBL6233301 0.67 GAA (0.46) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL4543295 0.67 CYP3A4 (0.35) CYP3A4MAPTL3MBTL1POLB

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-1070706-B1 Process for the preparation of 1-substituted 5-hydroxy-imidazolin-2,4-diones and 1-substituted 5-alkoxy-imidazolin-2,4-diones BAYER CHEMICALS AG (DE) 2004-02-18 EP disclosed
US-6365752-B1 REACTING GLYOXYLIC ACID AND AN N-SUBSTITUTED UREA IN AQUEOUS SOLUTION AND IN THE PRESENCE OF AN ACID CATALYST; EFFICIENCY; PURITY; NONTOXIC CHEMICAL INTERMEDIATES FOR DRUGS; INSECTICIDES; AMINO ACIDS AND TEXTILE ASSISTANTS BAYER AKTIENGESELLSCHAFT (DE) 2002-04-02 US disclosed
EP-1070706-A1 Process for the preparation of 1-substituted 5-hydroxy-imidazolin-2,4-diones and 1-substituted 5-alkoxy-imidazolin-2,4-diones BAYER AG (DE) 2001-01-24 EP disclosed