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Sugi Predict / Compounds / SCHEMBL1960183

SCHEMBL1960183

SCHEMBL1960183

CC(C)(C)C[C@@H]1N[C@@H](C(=O)Nc2ccc(C#N)cc2)[C@H](c2cccc(Cl)c2)C12C(=O)Nc1cc(Cl)ccc12

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 0.67
▸ TP53 P04637 7/20 0.65

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
SCHEMBL1958889 1.00 MDM2 (0.67) MDM2TP53
SCHEMBL223034 1.00 MDM2 (0.67) MDM2TP53
SCHEMBL1957577 0.90 MDM2 (0.68) MDM2TP53
SCHEMBL221021 0.90 MDM2 (0.68) MDM2TP53
SCHEMBL1960298 0.90 MDM2 (0.68) MDM2TP53
SCHEMBL222128 0.90 MDM2 (0.68) MDM2TP53
SCHEMBL223578 0.89 MDM2 (0.69) MDM2TP53
SCHEMBL1958162 0.89 MDM2 (0.69) MDM2TP53
SCHEMBL1955501 0.89 MDM2 (0.78) MDM2TP53
SCHEMBL220607 0.89 MDM2 (0.78) MDM2TP53

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
WO-2011067185-A1 SPIROINDOLINONE PYRROLIDINES F. HOFFMANN-LA ROCHE AG (CH) 2011-06-09 — — WO disclosed