SCHEMBL3239157

SCHEMBL3239157

NC(=O)OC1CCN(C(=O)C2CCCN(C3(Cc4cccc(Cl)c4)C(=O)Nc4cc(Cl)ccc43)C2)CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 5/20 0.49
TP53 P04637 4/20 0.49
DGAT2 Q96PD7 2/20 0.39
ALDH1A1 P00352 1/20 0.38
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
ACHE P22303 1/20 0.34
MEN1 O00255 1/20 0.34
L3MBTL1 Q9Y468 1/20 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
SCHEMBL1319625 0.91 MDM2 (0.52) MDM2TP53DGAT2ALDH1A1KMT2A
SCHEMBL3252191 0.89 MDM2 (0.53) MDM2TP53KDM4EKMT2AMEN1
SCHEMBL3239254 0.87 MDM2 (0.49) MDM2TP53KMT2AMEN1
SCHEMBL1322410 0.87 MDM2 (0.53) MDM2TP53DGAT2ALDH1A1KMT2A
SCHEMBL1320670 0.87 MDM2 (0.55) MDM2TP53DGAT2ALDH1A1KDM4E
SCHEMBL1321776 0.87 MDM2 (0.61) MDM2TP53DGAT2ALDH1A1KDM4E
SCHEMBL1325985 0.86 MDM2 (0.55) MDM2TP53KDM4EKMT2AMEN1
SCHEMBL1320856 0.85 MDM2 (0.51) MDM2TP53DGAT2ALDH1A1KDM4E
SCHEMBL1320616 0.84 MDM2 (0.51) MDM2TP53DGAT2ALDH1A1KDM4E
SCHEMBL1322760 0.84 MDM2 (0.56) MDM2TP53KDM4EKMT2AMEN1

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