SCHEMBL3248187

SCHEMBL3248187

O=C(NC(CO)CO)OC1CCCN(C2(Cc3cccc(Cl)c3)C(=O)Nc3cc(Cl)ccc32)C1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 12/20 0.48
TP53 P04637 5/20 0.48
BCHE P06276 2/20 0.34
MAOB P27338 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL3250970 0.88 MDM2 (0.49) MDM2TP53BCHEMAOBL3MBTL1
SCHEMBL3241327 0.87 MDM2 (0.53) MDM2TP53L3MBTL1KDM4EMEN1
SCHEMBL1319816 0.87 MDM2 (0.50) MDM2TP53KDM4E
SCHEMBL3252191 0.86 MDM2 (0.53) MDM2TP53L3MBTL1KDM4EMEN1
SCHEMBL3239013 0.82 MDM2 (0.46) MDM2TP53
SCHEMBL1321485 0.80 MDM2 (0.56) MDM2TP53MAOBMEN1KMT2A
SCHEMBL1322760 0.79 MDM2 (0.56) MDM2TP53KDM4EMEN1KMT2A
SCHEMBL1325985 0.79 MDM2 (0.55) MDM2TP53L3MBTL1KDM4EMEN1
SCHEMBL1321538 0.78 MDM2 (0.51) MDM2TP53
SCHEMBL27875552 0.77 MDM2 (0.51) MDM2TP53KDM4EKMT2A

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
EP-2066318-B1 OXINDOLE DERIVATIVES AS ANTICANCER AGENTS HOFFMANN LA ROCHE (CH) 2010-05-12 EP claimed