SCHEMBL15930953

SCHEMBL15930953

CSNC(=O)c1nc(N[C@H](C)C2CCC2)c2c(n1)nc(N1CCOC[C@H]1c1ccccc1)n2C[C@H]1CC[C@H](C)CC1

nearest known ligand 0.85

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 20/20 0.85
▸ TP53 P04637 2/20 0.85

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
SCHEMBL17314678 0.93 MDM2 (0.88) MDM2TP53
SCHEMBL17314677 0.93 MDM2 (0.88) MDM2TP53
SCHEMBL17314099 0.92 MDM2 (1.00) MDM2TP53
SCHEMBL15931490 0.92 MDM2 (1.00) MDM2TP53
SCHEMBL15930951 0.92 MDM2 (1.00) MDM2TP53
SCHEMBL17314479 0.92 MDM2 (1.00) MDM2TP53
SCHEMBL17314596 0.91 MDM2 (1.00) MDM2TP53
SCHEMBL15931393 0.91 MDM2 (1.00) MDM2TP53
SCHEMBL15931507 0.90 MDM2 (1.00) MDM2TP53
SCHEMBL17314769 0.90 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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