SCHEMBL20105853

SCHEMBL20105853

C#C[C@H]1CC[C@H](Cn2c(N3CCCCC3C(C)C)nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c32)CC1

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 0.83

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
SCHEMBL17314017 0.91 MDM2 (1.00) MDM2
SCHEMBL15931053 0.91 MDM2 (1.00) MDM2
SCHEMBL20105392 0.89 MDM2 (0.83) MDM2
SCHEMBL20105300 0.84 MDM2 (0.83) MDM2
SCHEMBL20105308 0.84 MDM2 (0.85) MDM2
SCHEMBL20105319 0.83 MDM2 (0.87) MDM2
SCHEMBL17314349 0.83 MDM2 (1.00) MDM2
SCHEMBL17314351 0.83 MDM2 (1.00) MDM2
SCHEMBL20105929 0.82 MDM2 (0.85) MDM2
SCHEMBL20105515 0.82 MDM2 (0.70) 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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