SCHEMBL20105540

SCHEMBL20105540

C#C[C@H]1CC[C@H](Cn2c(N(C)Cc3nonc3C)nc3nc(-c4noc(=O)[nH]4)nc(N[C@H](C)C4CCC4)c32)CC1

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 0.85

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
SCHEMBL15930891 0.92 MDM2 (1.00) MDM2
SCHEMBL17314148 0.92 MDM2 (1.00) MDM2
SCHEMBL20105982 0.89 MDM2 (0.84) MDM2
SCHEMBL20105914 0.86 MDM2 (0.85) MDM2
SCHEMBL20106379 0.81 MDM2 (0.83) MDM2
SCHEMBL17323808 0.81 MDM2 (1.00) MDM2
SCHEMBL17323794 0.81 MDM2 (1.00) MDM2
SCHEMBL15930885 0.80 MDM2 (1.00) MDM2
SCHEMBL17314068 0.80 MDM2 (1.00) MDM2
SCHEMBL17323801 0.80 MDM2 (1.00) 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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