SCHEMBL29444044

SCHEMBL29444044

CC[C@H](N)C(=O)NCCOCCOCCOCCOCCOCCOCCOC

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ TLR2 O60603 12/20 0.42
▸ USP2 O75604 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ CA2 P00918 3/20 0.40
▸ DPP7 Q9UHL4 1/20 0.40
▸ S1PR2 O95136 2/20 0.39
▸ S1PR1 P21453 2/20 0.39
▸ S1PR3 Q99500 2/20 0.39
▸ S1PR5 Q9H228 1/20 0.39

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
SCHEMBL14012316 0.85 MEN1 (0.50) MEN1KMT2ATLR2CA2
SCHEMBL29430501 0.84 MEN1 (0.49) MEN1KMT2ATLR2CA2S1PR1
SCHEMBL18089443 0.84 MEN1 (0.49) MEN1KMT2ATLR2CA2DPP7
SCHEMBL23158601 0.83 MEN1 (0.47) MEN1KMT2ATLR2CA2DPP7
SCHEMBL7298639 0.83 MEN1 (0.51) MEN1KMT2ATLR2USP2TSHR
SCHEMBL15503581 0.82 MEN1 (0.47) MEN1KMT2ATLR2CA2DPP7
SCHEMBL25708285 0.81 MEN1 (0.46) MEN1KMT2ATLR2TSHRCA2
SCHEMBL13566444 0.81 CA2 (0.50) MEN1KMT2ATLR2CA2DPP7
SCHEMBL12266591 0.81 CA2 (0.50) MEN1KMT2ATLR2CA2DPP7
SCHEMBL7300946 0.81 MEN1 (0.58) MEN1KMT2ATLR2CA2DPP7

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
CN-114173824-A Antibody drug conjugates 武田药品工业株式会社 2022-03-11 — — CN disclosed
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