SCHEMBL20105666

SCHEMBL20105666

CC1CCCN(c2nc3nc(C(=N)NC(=O)O)nc(N[C@H](C)C4CCC4)c3n2C[C@H]2CC[C@H](C)CC2)C1c1ccccc1

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 0.84
▸ TP53 P04637 1/20 0.63

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
SCHEMBL17313954 0.92 MDM2 (0.83) MDM2TP53
SCHEMBL20105497 0.92 MDM2 (0.81) MDM2TP53
SCHEMBL15930807 0.92 MDM2 (1.00) MDM2TP53
SCHEMBL17314590 0.92 MDM2 (1.00) MDM2TP53
SCHEMBL20105908 0.90 MDM2 (0.84) MDM2TP53
SCHEMBL20105826 0.88 MDM2 (0.72) MDM2TP53
SCHEMBL17313953 0.88 MDM2 (0.84) MDM2TP53
SCHEMBL17313952 0.88 MDM2 (0.84) MDM2TP53
SCHEMBL20105697 0.86 MDM2 (0.85) MDM2TP53
SCHEMBL20105885 0.86 MDM2 (0.83) 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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