SCHEMBL15924900

SCHEMBL15924900

CC(C)C[C@H]1CCCCN1c1nc2nc(C(N)=NO)nc(NCCC3CCC3)c2n1C[C@H]1CC[C@H](C)CC1

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 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
SCHEMBL15924901 0.87 MDM2 (0.62) MDM2
SCHEMBL15924899 0.87 MDM2 (0.82) MDM2
SCHEMBL17314857 0.87 MDM2 (0.82) MDM2
SCHEMBL17314885 0.87 MDM2 (0.82) MDM2
SCHEMBL15921834 0.80 MDM2 (0.43) MDM2
SCHEMBL15930806 0.77 MDM2 (1.00) MDM2
SCHEMBL17314045 0.77 MDM2 (1.00) MDM2
SCHEMBL17314673 0.76 MDM2 (0.82) MDM2
SCHEMBL17314672 0.76 MDM2 (0.82) MDM2
SCHEMBL17314854 0.76 MDM2 (0.82) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2951180-A1 2,6,7,8 SUBSTITUTED PURINES AS HDM2 INHIBITORS Merck Sharp & Dohme Corp. (US) 2015-12-09 — — EP disclosed
WO-2014120748-A1 2,6,7,8 SUBSTITUTED PURINES AS HDM2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-08-07 — — WO disclosed
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