SCHEMBL10404397

SCHEMBL10404397

CCN1CCN(C(=O)NC([C]=O)CSC)C(=O)C1=O

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ POLB P06746 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL10546548 0.89 GAA (0.34) GAAL3MBTL1POLB
SCHEMBL10810781 0.89 GAA (0.34) GAAL3MBTL1POLB
SCHEMBL10404211 0.88 GAA (0.36) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL10543143 0.85 GAA (0.37) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL10546522 0.85 GAA (0.37) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL9348172 0.84 GAA (0.38) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL10545995 0.83 GAA (0.39) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL10544918 0.82 GAA (0.40) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL10736558 0.81 GAA (0.34) GAAL3MBTL1POLB
SCHEMBL10545798 0.81 GAA (0.34) GAAL3MBTL1POLB

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
US-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 — — US disclosed
EP-0226896-A2 Lankacidin derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1987-07-01 — — EP disclosed
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