SCHEMBL20106476

SCHEMBL20106476

CN/C(=N\OC=O)c1nc(NC(C)C2CCC2)c2c(n1)nc(C1(c3ccccc3F)CC1)n2CC1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 0.55

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
SCHEMBL20106397 0.82 MDM2 (0.61) MDM2
SCHEMBL20105788 0.77 MDM2 (0.57) MDM2
SCHEMBL20106351 0.72 MDM2 (0.66) MDM2
SCHEMBL15924078 0.71 MDM2 (1.00) MDM2
SCHEMBL17323837 0.71 MDM2 (1.00) MDM2
SCHEMBL15924080 0.71 MDM2 (1.00) MDM2
SCHEMBL20106396 0.70 MDM2 (0.85) MDM2
SCHEMBL20106342 0.70 MDM2 (0.74) MDM2
SCHEMBL17314763 0.70 MDM2 (1.00) MDM2
SCHEMBL15931582 0.70 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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