SCHEMBL10404398

SCHEMBL10404398

CCC([C]=S)NC(=O)N1CCN(CC)C(=O)C1=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ POLB P06746 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC2 Q92769 1/20 0.31
▸ MAPT P10636 1/20 0.30
▸ PDE3A Q14432 1/20 0.30
▸ SLC22A6 Q4U2R8 1/20 0.30
▸ SLC22A8 Q8TCC7 1/20 0.30
▸ SLC22A11 Q9NSA0 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL10404211 0.88 GAA (0.36) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL10403864 0.82 GAA (0.37) GAAL3MBTL1POLBSMN1; SMN2HDAC1
SCHEMBL10543143 0.80 GAA (0.37) GAAL3MBTL1POLBSMN1; SMN2HDAC1
SCHEMBL10546522 0.80 GAA (0.37) GAAL3MBTL1POLBSMN1; SMN2HDAC1
SCHEMBL14866125 0.79 GAA (0.47) GAAL3MBTL1POLBSMN1; SMN2HDAC1
SCHEMBL10404397 0.78 GAA (0.36) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL10544918 0.78 GAA (0.40) GAAL3MBTL1POLBSMN1; SMN2HDAC1
SCHEMBL10545995 0.77 GAA (0.39) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL10332637 0.77 GAA (0.40) GAAL3MBTL1POLBSMN1; SMN2HDAC1
SCHEMBL10546566 0.77 GAA (0.40) GAAL3MBTL1POLBSMN1; SMN2HDAC1

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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