SCHEMBL20106299

SCHEMBL20106299

C[C@@H]1CC[C@H]2Cn3c(nc4nc(C(=N)NC(=O)O)nc(N[C@H](C)C5CCC5)c43)C3C2=C1OCC3c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 0.46
▸ TP53 P04637 3/20 0.40

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
SCHEMBL20105713 0.88 MDM2 (0.48) MDM2
SCHEMBL20106477 0.83 MDM2 (0.47) MDM2
SCHEMBL20106304 0.81 MDM2 (0.43) MDM2
SCHEMBL20105819 0.75 MDM2 (0.43) MDM2
SCHEMBL20105712 0.72 MDM2 (0.84) MDM2TP53
SCHEMBL20106046 0.72 MDM2 (0.53) MDM2
SCHEMBL20105547 0.71 MDM2 (0.55) MDM2TP53
SCHEMBL20105368 0.71 MDM2 (0.55) MDM2TP53
SCHEMBL20106386 0.70 MDM2 (0.49) MDM2
SCHEMBL20106139 0.69 MDM2 (0.76) MDM2

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-2951180-B1 2,6,7,8 SUBSTITUTED PURINES AS HDM2 INHIBITORS MERCK SHARP & DOHME (US) 2018-05-02 — — EP disclosed
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