SCHEMBL20106004

SCHEMBL20106004

C=C[C@H]1CC[C@H](Cn2c(N3CCOC[C@H]3c3ccncc3)nc3nc(-c4noc(=O)[nH]4)nc(N[C@H](C)C4CCC4)c32)CC1

nearest known ligand 0.86

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 0.86
▸ TP53 P04637 1/20 0.77

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
SCHEMBL15931531 0.93 MDM2 (1.00) MDM2TP53
SCHEMBL17314405 0.93 MDM2 (1.00) MDM2TP53
SCHEMBL20105360 0.87 MDM2 (0.86) MDM2TP53
SCHEMBL15931263 0.87 MDM2 (1.00) MDM2TP53
SCHEMBL17314534 0.87 MDM2 (1.00) MDM2TP53
SCHEMBL17314505 0.87 MDM2 (1.00) MDM2TP53
SCHEMBL17314039 0.87 MDM2 (1.00) MDM2TP53
SCHEMBL17314504 0.87 MDM2 (1.00) MDM2TP53
SCHEMBL15931488 0.87 MDM2 (1.00) MDM2TP53
SCHEMBL15931325 0.86 MDM2 (1.00) 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
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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