SCHEMBL4255324

SCHEMBL4255324

N[C@H](C(=O)O)C(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.54
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
LMNA P02545 4/20 0.52
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
SLC1A2 P43004 4/20 0.47
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SRC P12931 1/20 0.43
CYP3A4 P08684 1/20 0.43
DPP4 P27487 2/20 0.43
SLC1A3 P43003 3/20 0.42
SLC1A1 P43005 3/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 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
SCHEMBL4255321 1.00 CYP2D6 (0.54) CYP2D6TDP1L3MBTL1LMNACES2
SCHEMBL2308229 0.84 CYP2D6 (0.70) CYP2D6LMNASLC1A2SRCDPP4
SCHEMBL7519804 0.84 CYP2D6 (0.70) CYP2D6LMNASLC1A2SRCDPP4
SCHEMBL7827857 0.82 CYP2D6 (0.74) CYP2D6TDP1L3MBTL1LMNACES2
Hydrochloric Acid SCHEMBL5693429 0.82 CYP2D6 (0.67) CYP2D6LMNASLC1A2SRCDPP4
SCHEMBL28830240 0.79 LMNA (0.65) CYP2D6TDP1L3MBTL1LMNACES2
SCHEMBL3576405 0.78 CYP2D6 (0.56) CYP2D6LMNASLC1A2SRCDPP4
SCHEMBL7598177 0.78 LMNA (0.59) CYP2D6TDP1L3MBTL1LMNACES2
SCHEMBL5606071 0.78 CYP2D6 (0.56) CYP2D6LMNASLC1A2SRCDPP4
SCHEMBL3630110 0.78 CYP2D6 (0.56) CYP2D6LMNASLC1A2SRCDPP4

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
CN-105143245-B Anti-scaling material 耶路撒冷希伯来大学伊森姆研究发展有限公司 2021-02-05 CN disclosed
US-8883453-B2 Codon specific mutagenesis UNIVERSITY OF MARYLAND (US) 2014-11-11 US disclosed
US-20090004702-A1 CODON SPECIFIC MUTAGENESIS UNIVERSITY OF MARYLAND-OFFICE OF TECHNOLOGY COMMERCIALIZATION (US) 2009-01-01 US disclosed