SCHEMBL29839944

SCHEMBL29839944

O=C(O)CNC(=O)CNC(=O)[C@H](Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NMBR P28336 1/20 0.46
▸ MDM4 O15151 2/20 0.44
▸ TP53 P04637 2/20 0.44
▸ SIRT2 Q8IXJ6 12/20 0.42

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
SCHEMBL29427171 0.97 NMBR (0.48) NMBRMDM4TP53SIRT2
SCHEMBL29759585 0.88 NMBR (0.47) NMBRMDM4TP53SIRT2
SCHEMBL1737899 0.87 MDM4 (0.54) MDM4TP53SIRT2
SCHEMBL12994493 0.87 MDM4 (0.54) MDM4TP53SIRT2
SCHEMBL13227674 0.87 MDM4 (0.54) MDM4TP53SIRT2
SCHEMBL30433831 0.87 MDM4 (0.54) MDM4TP53SIRT2
SCHEMBL29368020 0.87 MDM4 (0.54) MDM4TP53SIRT2
SCHEMBL29427173 0.86 MDM4 (0.46) NMBRMDM4TP53SIRT2
SCHEMBL30468161 0.85 SIRT2 (0.55) NMBRMDM4TP53SIRT2
SCHEMBL30385679 0.85 MDM4 (0.49) NMBRMDM4TP53SIRT2

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-4306533-A1 SYNTHETIC PEPTIDE AND APPLICATION THEREOF Wuhan Innerse Pharmaceutical Inc. (CN) 2024-01-17 — — EP disclosed
US-20240002435-A1 SYNTHETIC PEPTIDE AND APPLICATION THEREOF WUHAN INNERSE PHARMACEUTICAL INC. (CN) 2024-01-04 — — US disclosed
WO-2022188877-A1 SYNTHETIC PEPTIDE AND APPLICATION THEREOF 武汉英纳氏药业有限公司 2022-09-15 — — WO disclosed
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