SCHEMBL15924126

SCHEMBL15924126

CC(Nc1nc(C(=O)O)nc2nc(C3=C(c4ccccc4)CCCC3)n(Cc3ccc(C(F)(F)F)cc3)c12)C1CCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 1.00
▸ 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
SCHEMBL15931486 1.00 MDM2 (1.00) MDM2TP53
SCHEMBL15922797 0.99 MDM2 (1.00) MDM2TP53
SCHEMBL20105607 0.99 MDM2 (1.00) MDM2TP53
SCHEMBL15924482 0.94 MDM2 (0.88) MDM2
SCHEMBL15924480 0.94 MDM2 (0.88) MDM2
SCHEMBL17323757 0.93 MDM2 (1.00) MDM2TP53
SCHEMBL15922021 0.92 MDM2 (1.00) MDM2
SCHEMBL15930737 0.90 MDM2 (0.94) MDM2
SCHEMBL15931144 0.89 MDM2 (1.00) MDM2TP53
SCHEMBL15924797 0.89 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 3 patents. 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
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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