SCHEMBL5027411

SCHEMBL5027411

CCCCOC(=O)[C@H](CCC(N)=O)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.38
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPK1 P28482 1/20 0.38
MAPT P10636 1/20 0.37
LMNA P02545 1/20 0.37
TDP1 Q9NUW8 2/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL2280493 0.85 TNF (0.47) TNFL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL2278593 0.85 TNF (0.47) TNFL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL2288486 0.84 ATM (0.46) TNFL3MBTL1POLBALDH1A1MEN1
SCHEMBL2168623 0.83 MEN1 (0.54) TNFPOLBALDH1A1MEN1KMT2A
SCHEMBL2282582 0.83 MEN1 (0.54) TNFPOLBALDH1A1MEN1KMT2A
SCHEMBL29790477 0.83 MEN1 (0.54) TNFPOLBALDH1A1MEN1KMT2A
SCHEMBL2282489 0.83 MEN1 (0.54) TNFPOLBALDH1A1MEN1KMT2A
SCHEMBL8534121 0.79 TNF (0.49) TNFPOLBALDH1A1MEN1KMT2A
SCHEMBL28680226 0.78 TNF (0.56) TNFL3MBTL1POLBALDH1A1MEN1
SCHEMBL7858417 0.77 TNF (0.58) TNFL3MBTL1POLBALDH1A1MEN1

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
EP-1907373-A1 PROCESSES FOR THE PREPARATION OF 4-AMINO-2-(2,6-DIOXOPIPERIDIN-3-YL)ISOINDOLINE-1,3-DIONE COMPOUNDS CELGENE CORPORATION (US) 2008-04-09 EP disclosed
WO-2007005972-A1 PROCESSES FOR THE PREPARATION OF 4-AMINO-2-(2,6-DIOXOPIPERIDIN-3-YL)ISOINDOLINE-1,3-DIONE COMPOUNDS CELGENE CORPORATION (US) 2007-01-11 WO disclosed