SCHEMBL222843

SCHEMBL222843

COC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)C3(C(=O)Nc4cc(Cl)ccc43)[C@H]2c2cccc(Cl)c2)c(OC)c1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 20/20 0.70
TP53 P04637 3/20 0.70
MDM4 O15151 7/20 0.67

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
SCHEMBL222842 1.00 MDM2 (0.70) MDM2TP53MDM4
SCHEMBL222410 0.94 MDM2 (0.79) MDM2TP53MDM4
SCHEMBL222411 0.94 MDM2 (0.79) MDM2TP53MDM4
SCHEMBL222534 0.94 MDM2 (0.79) MDM2TP53MDM4
SCHEMBL1958798 0.94 MDM2 (0.79) MDM2TP53MDM4
SCHEMBL222484 0.94 MDM2 (0.79) MDM2TP53MDM4
SCHEMBL222172 0.91 MDM2 (0.68) MDM2TP53MDM4
SCHEMBL222576 0.91 MDM2 (0.70) MDM2TP53MDM4
SCHEMBL222575 0.91 MDM2 (0.70) MDM2TP53MDM4
SCHEMBL222264 0.91 MDM2 (0.70) MDM2TP53MDM4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088815-B2 Spiroindolinone pyrrolidines HOFFMAN-LA ROCHE INC. (US) 2012-01-03 US claimed
US-8088815-B2 Spiroindolinone pyrrolidines HOFFMAN-LA ROCHE INC. (US) 2012-01-03 US disclosed