SCHEMBL3244870

SCHEMBL3244870

CC(=O)N1CCN(OC(=O)NC2CCCCN2[C@]2(Cc3cccc(Cl)c3)C(=O)Nc3cc(Cl)ccc32)CC1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 11/20 0.52
TP53 P04637 6/20 0.52
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
ACHE P22303 3/20 0.33
RORC P51449 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
SCHEMBL1319277 0.91 MDM2 (0.56) MDM2TP53MEN1ALDH1A1LMNA
SCHEMBL3245804 0.90 MDM2 (0.44) MDM2TP53
SCHEMBL3244735 0.89 MDM2 (0.42) MDM2TP53
SCHEMBL3249735 0.89 MDM2 (0.43) MDM2TP53MEN1ALDH1A1LMNA
SCHEMBL1322315 0.85 MDM2 (0.50) MDM2TP53KMT2A
SCHEMBL1319860 0.82 MDM2 (0.46) MDM2TP53MEN1LMNAKMT2A
SCHEMBL1319807 0.82 MDM2 (0.48) MDM2TP53
SCHEMBL1319265 0.81 MDM2 (0.46) MDM2TP53ACHE
SCHEMBL8206478 0.76 MDM2 (0.59) MDM2TP53MEN1ALDH1A1LMNA
SCHEMBL3241269 0.76 MDM2 (0.51) MDM2TP53ACHE

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