SCHEMBL20106236

SCHEMBL20106236

CC(Nc1nc(C(=O)O)nc2nc(C3CCCC3c3ccccc3)n(Cc3ccc(C(F)(F)F)cc3)c12)C1CCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 1.00

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
SCHEMBL15924545 1.00 MDM2 (1.00) MDM2
SCHEMBL15931075 0.99 MDM2 (1.00) MDM2
SCHEMBL15921810 0.93 MDM2 (0.88) MDM2
SCHEMBL20105659 0.93 MDM2 (1.00) MDM2
SCHEMBL15924910 0.93 MDM2 (1.00) MDM2
SCHEMBL20106019 0.92 MDM2 (0.86) MDM2
SCHEMBL15922705 0.91 MDM2 (1.00) MDM2
SCHEMBL20106353 0.88 MDM2 (0.80) MDM2
SCHEMBL15930763 0.88 MDM2 (1.00) MDM2
SCHEMBL15921960 0.88 MDM2 (1.00) 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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