SCHEMBL3242780

SCHEMBL3242780

CC(C)CCC(=O)ONC1(Cc2cccc(Cl)c2)C(=O)Nc2cc(Cl)ccc21

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 15/20 0.54
TP53 P04637 12/20 0.46
MAOB P27338 1/20 0.36
PGR P06401 1/20 0.34
NR3C2 P08235 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
SCHEMBL27753713 0.92 MDM2 (0.52) MDM2TP53MAOBPGR
SCHEMBL27753811 0.86 MDM2 (0.53) MDM2TP53MAOBPGR
SCHEMBL27774432 0.85 MDM2 (0.56) MDM2TP53MAOBPGR
SCHEMBL1319361 0.81 MDM2 (0.52) MDM2TP53MAOBPGR
SCHEMBL1319835 0.79 MDM2 (0.49) MDM2TP53MAOB
SCHEMBL27875560 0.78 MDM2 (0.65) MDM2TP53MAOBPGR
SCHEMBL8203035 0.78 MDM2 (0.60) MDM2TP53MAOBPGRNR3C2
SCHEMBL1322276 0.78 MDM2 (0.57) MDM2TP53MAOBPGRNR3C2
SCHEMBL1321543 0.77 MDM2 (0.48) MDM2TP53MAOB
SCHEMBL1319495 0.77 MDM2 (0.54) MDM2TP53MAOBPGR

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