SCHEMBL20105327

SCHEMBL20105327

COc1cccc(-c2nc3nc(C=O)nc(N[C@H](C)C4CC4)c3n2Cc2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 0.78

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
SCHEMBL20105558 0.90 MDM2 (0.77) MDM2
SCHEMBL20105584 0.88 MDM2 (0.74) MDM2
SCHEMBL15924922 0.88 MDM2 (1.00) MDM2
SCHEMBL20105195 0.86 MDM2 (0.77) MDM2
SCHEMBL15930775 0.86 MDM2 (1.00) MDM2
SCHEMBL15922103 0.86 MDM2 (0.89) MDM2
SCHEMBL15922128 0.86 MDM2 (1.00) MDM2
SCHEMBL15922101 0.86 MDM2 (0.89) MDM2
SCHEMBL20105524 0.86 MDM2 (0.78) MDM2
SCHEMBL15921563 0.85 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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