SCHEMBL7574865

SCHEMBL7574865

CC(N)/C(C(=O)O)=C(\C(=O)O)C(C)N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.43
GABRP O00591 4/20 0.38
GABRD O14764 4/20 0.38
GABRA1 P14867 4/20 0.38
GABRB1 P18505 4/20 0.38
GABRG2 P18507 4/20 0.38
GABRB3 P28472 4/20 0.38
GABRA5 P31644 4/20 0.38
GABRA3 P34903 4/20 0.38
GABRA2 P47869 4/20 0.38
GABRB2 P47870 4/20 0.38
GABRA4 P48169 4/20 0.38
GABRE P78334 4/20 0.38
GABRA6 Q16445 4/20 0.38
GABRG1 Q8N1C3 4/20 0.38
GABRG3 Q99928 4/20 0.38
GABRQ Q9UN88 4/20 0.38
TP53 P04637 1/20 0.37
GRIK1 P39086 2/20 0.33
GRIA2 P42262 2/20 0.33

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
SCHEMBL7574882 1.00 SLC7A5 (0.43) SLC7A5GABRPGABRDGABRA1GABRB1
SCHEMBL2385953 0.85 GRIK1 (0.38) SLC7A5GABRPGABRDGABRA1GABRB1
Chloromethane SCHEMBL203880 0.81 GRIK1 (0.35) SLC7A5GABRPGABRDGABRA1GABRB1
SCHEMBL18283238 0.79 GRIK1 (0.45) SLC7A5GABRPGABRDGABRA1GABRB1
Alanine SCHEMBL27491774 0.76 SLC7A5 (0.53) SLC7A5GABRPGABRDGABRA1GABRB1
Alanine SCHEMBL31 0.74
Alanine SCHEMBL452350 0.74 SLC7A5 (0.59) SLC7A5GABRPGABRDGABRA1GABRB1
Oxalic Acid SCHEMBL21145318 0.74 SLC7A5 (0.50) SLC7A5GABRPGABRDGABRA1GABRB1
Alanine SCHEMBL1332110 0.74
Alanine SCHEMBL254290 0.74 SLC7A5 (0.59) SLC7A5GABRPGABRDGABRA1GABRB1

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-0906351-B1 PHOTOPOLYMERIZABLE POLYESTER COMPOSITION AND PROCESS FOR THE PRODUCTION THEREOF EASTMAN CHEMICAL SWEDEN AB (SE) 2002-09-04 EP disclosed
EP-0906351-A1 PHOTOPOLYMERIZABLE POLYESTER COMPOSITION AND PROCESS FOR THE PRODUCTION THEREOF McWhorter Technologies AB (SE) 1999-04-07 EP disclosed
WO-1997048744-A1 PHOTOPOLYMERIZABLE POLYESTER COMPOSITION AND PROCESS FOR THE PRODUCTION THEREOF MCWHORTER TECHNOLOGIES AB (SE) 1997-12-24 WO disclosed