SCHEMBL27554698

SCHEMBL27554698

COC(CC(=O)CN)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
GABRR1 P24046 3/20 0.37
SLC1A3 P43003 1/20 0.35
SLC1A2 P43004 1/20 0.35
SLC1A1 P43005 1/20 0.35
SRR Q9GZT4 1/20 0.32
GLRA1 P23415 1/20 0.32
SLC6A9 P48067 1/20 0.32
OR51E2 Q9H255 1/20 0.32
PPARG P37231 2/20 0.30
PPARD Q03181 2/20 0.30
PPARA Q07869 2/20 0.30
LAP3 P28838 2/20 0.30

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
SCHEMBL8499223 0.77 SLC1A3 (0.38) LMNASLC1A3SLC1A2SLC1A1SRR
SCHEMBL2580759 0.77 TDP1 (0.43) LMNAGABRR1SLC1A3SLC1A2SLC1A1
SCHEMBL10212 0.77 TDP1 (0.43) LMNAGABRR1SLC1A3SLC1A2SLC1A1
SCHEMBL2593546 0.77 TDP1 (0.43) LMNAGABRR1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL28754350 0.77
SCHEMBL6539858 0.77
SCHEMBL10029740 0.75 ALDH1A1 (0.42) LMNASLC1A3SLC1A2SLC1A1SRR
SCHEMBL11672388 0.75 TDP1 (0.42) LMNAGABRR1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL28487836 0.75 GABRR1 (0.52) KDM4ELMNAGABRR1GLRA1SLC6A9
SCHEMBL6742371 0.75 TDP1 (0.42) LMNAGABRR1SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104069493-A Use of aminolevulinic acid and derivatives thereof PHOTOCURE ASA 2014-10-01 CN disclosed
CN-101896203-A Use of solid forms of 5-aminolevulinic acid and derivatives in photodynamic therapy and diagnosis PHOTOCURE ASA 2010-11-24 CN disclosed
CN-101631541-A Application of aminolevulinic acid and derivatives thereof PHOTOCURE ASA 2010-01-20 CN disclosed
CN-1318388-C Esters of 5-aminolevulinic acid as photosensitizing agents in photochemotherapy PHOTOCURE A S (NO) 2007-05-30 CN disclosed
CN-1460099-A Esters of 5-aminolevulinic acid as photosensitizing agents in photochemotherapy PHOTOCURE AS (NO) 2003-12-03 CN disclosed