SCHEMBL8316864

SCHEMBL8316864

CCOC(=O)OC1CC(C)C(C)N1C(=O)Cc1c(C)cccc1C

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
MAPT P10636 3/20 0.38
NLRP3 Q96P20 2/20 0.35
HTT P42858 1/20 0.34
KMT2A Q03164 6/20 0.34
MEN1 O00255 5/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
MAPK1 P28482 1/20 0.31
CHRM1 P11229 1/20 0.31
PTGDR2 Q9Y5Y4 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
SCHEMBL8317719 0.89 KMT2A (0.43) ALDH1A1KMT2AMEN1L3MBTL1SMN1; SMN2
SCHEMBL8317101 0.88 L3MBTL1 (0.33) ALDH1A1NLRP3KMT2AMEN1L3MBTL1
SCHEMBL8312985 0.85 ALDH1A1 (0.34) ALDH1A1MAPTNLRP3HTTKMT2A
SCHEMBL8317256 0.82 ALDH1A1 (0.39) ALDH1A1MAPTNLRP3HTTKMT2A
SCHEMBL8316895 0.82 HSD11B1 (0.33) ALDH1A1MAPTHTTKMT2AMEN1
SCHEMBL8317855 0.81 KMT2A (0.34) ALDH1A1MAPTNLRP3HTTKMT2A
SCHEMBL8876261 0.81 KMT2A (0.42) ALDH1A1MAPTKMT2AMEN1L3MBTL1
SCHEMBL8317735 0.81 SMN1; SMN2 (0.37) ALDH1A1MAPTNLRP3KMT2AMEN1
SCHEMBL8318118 0.81 ALDH1A1 (0.45) ALDH1A1MAPTHTTKMT2AMEN1
SCHEMBL8313747 0.79 ALDH1A1 (0.35) ALDH1A1MAPTNLRP3HTTKMT2A

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
EP-0501129-B1 Substituted bicyclic 3-arylpyrrolidin-2,4-dion derivatives BAYER AG (DE) 1999-07-14 EP disclosed
EP-0501129-A1 Substituted bicyclic 3-arylpyrrolidin-2,4-dion derivatives BAYER AG (DE) 1992-09-02 EP disclosed