SCHEMBL27899232

SCHEMBL27899232

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
ALDH1A1 P00352 4/20 0.45
HCAR2 Q8TDS4 1/20 0.44
KMT2A Q03164 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
CA12 O43570 3/20 0.42
CA9 Q16790 3/20 0.42
AKR1B10 O60218 1/20 0.42
AKR1B1 P15121 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
SLC1A3 P43003 2/20 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
SCHEMBL1273252 0.82 ALDH1A1 (0.49) LMNAALDH1A1HCAR2KMT2ATDP1
SCHEMBL4622404 0.81 ALDH1A1 (0.51) LMNAALDH1A1HCAR2KMT2ATDP1
Hydrochloric Acid SCHEMBL10636148 0.80 ALDH1A1 (0.50) LMNAALDH1A1HCAR2KMT2ATDP1
SCHEMBL27963832 0.80 ALDH1A1 (0.41) LMNAALDH1A1HCAR2KMT2ATDP1
SCHEMBL28878826 0.79 ALDH1A1 (0.43) LMNAALDH1A1HCAR2KMT2ATDP1
SCHEMBL9298930 0.79 ALDH1A1 (0.51) LMNAALDH1A1KMT2ATDP1MAPK1
SCHEMBL7398999 0.78 ALDH1A1 (0.50) LMNAALDH1A1KMT2ATDP1MAPK1
SCHEMBL10789564 0.78 ALDH1A1 (0.50) LMNAALDH1A1HCAR2KMT2ATDP1
SCHEMBL4623371 0.78 ALDH1A1 (0.55) LMNAALDH1A1HCAR2KMT2ATDP1
SCHEMBL2387321 0.77 ALDH1A1 (0.38) LMNAALDH1A1HCAR2KMT2ATDP1

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-104693193-A Arylmethoxy isoindoline derivatives and compositions comprising and methods of using the same CELGENE CORP 2015-06-10 CN disclosed
CN-102822165-B Arylmethoxy isoindoline derivatives and compositions comprising and methods of using the same CELGENE CORP 2015-02-25 CN disclosed
CN-102822165-A Arylmethoxy isoindoline derivatives and compositions comprising and methods of using the same CELGENE CORP 2012-12-12 CN disclosed