SCHEMBL28672685

SCHEMBL28672685

COC(=O)C(CCCNC(=N)N)NC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ GAA P10253 1/20 0.47
▸ CTSK P43235 9/20 0.44
▸ CTSS P25774 5/20 0.44
▸ NPY4R P50391 2/20 0.41
▸ NPY1R P25929 1/20 0.41
▸ CAPN1 P07384 1/20 0.41
▸ MAOA P21397 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ TDP1 Q9NUW8 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ JAK3 P52333 1/20 0.40
▸ BTK Q06187 1/20 0.40
▸ ITGB3 P05106 1/20 0.39
▸ ITGA2B P08514 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ P2RY2 P41231 1/20 0.38
▸ CTSL P07711 1/20 0.38

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
SCHEMBL5849013 1.00 MEN1 (0.47) MEN1KMT2AGAACTSKCTSS
Hydrochloric Acid SCHEMBL10870558 0.99 MEN1 (0.46) MEN1KMT2AGAACTSKCTSS
SCHEMBL25469335 0.89 MEN1 (0.49) MEN1KMT2AGAACTSKCTSS
SCHEMBL30910784 0.89 CTSK (0.46) MEN1KMT2AGAACTSKCTSS
SCHEMBL7364210 0.88 MEN1 (0.55) MEN1KMT2AGAACTSKCTSS
SCHEMBL12267031 0.88 MEN1 (0.48) MEN1KMT2AGAACTSKCTSS
SCHEMBL2367531 0.88 MEN1 (0.55) MEN1KMT2AGAACTSKCTSS
SCHEMBL13778728 0.88 MEN1 (0.48) MEN1KMT2AGAACTSKCTSS
SCHEMBL1486276 0.88 MEN1 (0.55) MEN1KMT2AGAACTSKCTSS
SCHEMBL30186579 0.88 MEN1 (0.60) MEN1KMT2AGAACTSKCTSS

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113754556-B Glass based on amino acid, preparation method and application thereof 中国科学院过程工程研究所 2022-10-25 — — CN disclosed
CN-113754556-A Glass based on amino acid, preparation method and application thereof 中国科学院过程工程研究所 2021-12-07 — — CN disclosed
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