SCHEMBL1413249

SCHEMBL1413249

CC(Br)C(=O)CCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 5/20 0.47
LMNA P02545 4/20 0.47
ALKBH5 Q6P6C2 1/20 0.47
SUCNR1 Q9BXA5 1/20 0.47
SLC15A2 Q16348 1/20 0.43
GABRP O00591 2/20 0.42
GABRD O14764 2/20 0.42
GABRA1 P14867 2/20 0.42
GABRB1 P18505 2/20 0.42
GABRG2 P18507 2/20 0.42
GABRB3 P28472 2/20 0.42
GABRA5 P31644 2/20 0.42
GABRA3 P34903 2/20 0.42
GABRA2 P47869 2/20 0.42
GABRB2 P47870 2/20 0.42
GABRA4 P48169 2/20 0.42
GABRE P78334 2/20 0.42
GABRA6 Q16445 2/20 0.42
GABRG1 Q8N1C3 2/20 0.42
GABRG3 Q99928 2/20 0.42

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
SCHEMBL11127655 0.78 CES2 (0.41) LMNAHDAC3HDAC1HDAC2HDAC8
SCHEMBL463465 0.78 EGLN1 (0.53) EGLN1LMNAALKBH5SUCNR1SLC15A2
Succinic Acid SCHEMBL8397315 0.76 EGLN1 (0.69) EGLN1LMNAALKBH5SUCNR1SLC15A2
SCHEMBL1435946 0.76
SCHEMBL10143323 0.76 LMNA (0.50) EGLN1LMNAALKBH5SUCNR1SLC15A2
Succinic Acid SCHEMBL11859340 0.75 EGLN1 (0.43) EGLN1LMNAALKBH5SUCNR1SLC15A2
SCHEMBL15823996 0.75 LMNA (0.43) EGLN1LMNAALKBH5SUCNR1SLC15A2
SCHEMBL1986431 0.74 GABRP (0.54) EGLN1LMNAALKBH5SUCNR1SLC15A2
SCHEMBL27375102 0.74
Succinic Acid SCHEMBL21081056 0.74 LMNA (0.64) EGLN1LMNAALKBH5SUCNR1SLC15A2

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-8022229-B2 Process for the preparation of alkyl 5-(dicarboximido) levulinate and alkyl 4-oxo-pentenoate ALFA-SYNTHON AB (SE) 2011-09-20 US disclosed
EP-1833790-B1 PROCESS FOR THE PREPARATION OF ALKYL 5-(DICARBOXIMIDO)LEVULINATE AND ALKYL 4-OXO-PENTENOATE ALFA SYNTHON AB (SE) 2011-03-16 EP disclosed
US-20080027233-A1 Process for the Preparation of Alkyl 5-(Dicarboximido) Levulinate and Alkyl 4-Oxopentenoate ESQUIRE AB (SE) 2008-01-31 US disclosed
EP-1833790-A1 PROCESS FOR THE PREPARATION OF ALKYL 5-(DICARBOXIMIDO)LEVULINATE AND ALKYL 4-OXO-PENTENOATE Biosynth AB (SE) 2007-09-19 EP disclosed
WO-2006048236-A1 PROCESS FOR THE PREPARATION OF ALKYL 5- (DICARBOXIMIDO) LEVULINATE AND ALKYL 4-OXO-PENTENOATE BIOSYNTH AB (SE) 2006-05-11 WO disclosed
US-5907058-A Synthesis of an acid addition salt of delta-aminolevulinic acid from 5-bromo levulinic acid esters MIDWEST RESEARCH INSTITUTE (US) 1999-05-25 US disclosed