SCHEMBL27670554

SCHEMBL27670554

NC(=O)OCCC(N)C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
SLC1A1 P43005 4/20 0.48
SLC1A3 P43003 3/20 0.48
IDO1 P14902 1/20 0.46
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 2/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
SLC15A1 P46059 1/20 0.44
LTA4H P09960 1/20 0.44
LAP3 P28838 1/20 0.44
SLC1A2 P43004 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2D6 P10635 2/20 0.43
MEN1 O00255 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL29087599 0.90 LMNA (0.56) LMNASLC1A1SLC1A3IDO1ALDH1A1
SCHEMBL7268383 0.86 ALDH1A1 (0.62) SLC1A1SLC1A3IDO1ALDH1A1KMT2A
SCHEMBL10678429 0.86 SLC1A1 (0.54) LMNASLC1A1SLC1A3IDO1ALDH1A1
Hydrochloric Acid SCHEMBL7268375 0.85 ALDH1A1 (0.60) SLC1A1SLC1A3IDO1ALDH1A1KMT2A
SCHEMBL14196105 0.84 SLC1A1 (0.48) LMNASLC1A1SLC1A3IDO1ALDH1A1
SCHEMBL27881559 0.84 CYP1A2 (0.53) LMNASLC1A1SLC1A3IDO1ALDH1A1
SCHEMBL9544573 0.84 CYP1A2 (0.53) LMNASLC1A1SLC1A3IDO1ALDH1A1
SCHEMBL10441465 0.83 IDO1 (0.53) LMNASLC1A1SLC1A3IDO1ALDH1A1
SCHEMBL4161005 0.83 IDO1 (0.53) LMNASLC1A1SLC1A3IDO1ALDH1A1
SCHEMBL4989088 0.83 LTA4H (0.48) SLC1A1SLC1A3IDO1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1946727-B (Poly) aminoacetamide derivatives of epipodophyllotoxin, their process of preparation and their applications in therapeutics as anticancer agents PF MEDICAMENT 2010-08-11 CN disclosed
CN-1946727-A (Poly) aminoacetamide derivatives of epipodophyllotoxin their process of preparation and their applications in therapeutics as anticancer agents PF MEDICAMENT (FR) 2007-04-11 CN disclosed