SCHEMBL28038428

SCHEMBL28038428

CNC(=O)C(OC)c1ccccc1COc1c(NC)cc(NC)cc1NC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 2/20 0.42
FABP5 Q01469 2/20 0.42
LMNA P02545 3/20 0.34
LPAR1 Q92633 2/20 0.32
KDM4E B2RXH2 2/20 0.32
RECQL P46063 1/20 0.32
ALDH1A1 P00352 6/20 0.32
GAA P10253 2/20 0.32
HPGD P15428 1/20 0.32
POLB P06746 2/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 4/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KMT2A Q03164 1/20 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
SCHEMBL27952309 0.86 FABP4 (0.38) FABP4FABP5LMNALPAR1KDM4E
SCHEMBL28038429 0.84 FABP4 (0.42) FABP4FABP5LMNALPAR1KDM4E
SCHEMBL15403047 0.83 FABP4 (0.47) FABP4FABP5LMNAKDM4ERECQL
SCHEMBL28038430 0.83 FABP4 (0.36) FABP4FABP5LMNAKDM4ERECQL
SCHEMBL15402300 0.82 FABP4 (0.42) FABP4FABP5LMNALPAR1ALDH1A1
SCHEMBL15402129 0.82 FABP4 (0.46) FABP4FABP5LMNALPAR1
SCHEMBL15402214 0.82 FABP4 (0.46) FABP4FABP5LMNAALDH1A1GAA
SCHEMBL28809569 0.81 FABP4 (0.38) FABP4FABP5LMNALPAR1KDM4E
SCHEMBL15375322 0.80 FABP4 (0.44) FABP4FABP5LMNAKDM4EALDH1A1
SCHEMBL15402296 0.79 ALDH1A1 (0.40) FABP4FABP5LMNAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103641731-B The manufacture method of phenylacetyl amine compound SUMITOMO CHEMICAL CO., LTD. (JP) 2015-10-28 CN disclosed