SCHEMBL3246137

SCHEMBL3246137

O=[C]C1CCCN(C2(Cc3cccc(Cl)c3)C(=O)Nc3cc(Cl)ccc32)C1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 14/20 0.52
TP53 P04637 13/20 0.52
PKM P14618 1/20 0.36
ACHE P22303 4/20 0.34

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
SCHEMBL1321485 0.87 MDM2 (0.56) MDM2TP53PKM
SCHEMBL1320307 0.85 MDM2 (0.52) MDM2TP53PKM
SCHEMBL1322760 0.84 MDM2 (0.56) MDM2TP53
SCHEMBL3970399 0.84 MDM2 (0.51) MDM2TP53PKM
SCHEMBL1325985 0.83 MDM2 (0.55) MDM2TP53
SCHEMBL1319084 0.82 MDM2 (0.53) MDM2TP53PKM
SCHEMBL3241327 0.82 MDM2 (0.53) MDM2TP53ACHE
SCHEMBL3252191 0.81 MDM2 (0.53) MDM2TP53
SCHEMBL12121928 0.81 MDM2 (0.52) MDM2TP53
SCHEMBL1322322 0.80 MDM2 (0.52) MDM2TP53PKM

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 disclosed