SCHEMBL23401264

SCHEMBL23401264

CCCCc1nn(-c2ccccc2C)c(O)c1C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPK14 Q16539 2/20 0.36
MAPK13 O15264 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
ALDH1A1 P00352 3/20 0.33
HSP90AA1 P07900 1/20 0.33
CDC25B P30305 1/20 0.32
HSD11B1 P28845 1/20 0.32
DHODH Q02127 1/20 0.32
SLC16A3 O15427 1/20 0.32
SLC16A1 P53985 1/20 0.32
MAPT P10636 3/20 0.32
THRB P10828 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL23403263 0.92 MAPK14 (0.37) POLBL3MBTL1MAPK14MAPK13MAPK12
SCHEMBL23400573 0.87 MAPK14 (0.41) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL23402728 0.85 POLB (0.38) POLBL3MBTL1ALDH1A1HSP90AA1CDC25B
SCHEMBL23401082 0.84 MAPT (0.36) POLBL3MBTL1ALDH1A1HSP90AA1CDC25B
SCHEMBL23402802 0.83 POLB (0.38) POLBL3MBTL1MAPK14MAPK13MAPK12
SCHEMBL23398608 0.83 POLB (0.37) POLBL3MBTL1ALDH1A1HSP90AA1CDC25B
SCHEMBL23399349 0.83 PDE4A (0.41) L3MBTL1MAPK14MAPK13MAPK12MAPK11
SCHEMBL23400711 0.82 POLB (0.36) POLBL3MBTL1ALDH1A1HSP90AA1CDC25B
SCHEMBL23402633 0.81 POLB (0.38) POLBL3MBTL1ALDH1A1HSP90AA1CDC25B
SCHEMBL23400568 0.81 DHODH (0.38) POLBL3MBTL1ALDH1A1HSP90AA1CDC25B

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
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed