SCHEMBL23399320

SCHEMBL23399320

CCc1[nH]n(-c2ccccc2)c(=O)c1-c1ccc(C)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 11/20 0.57
ALOX15 P16050 1/20 0.57
MAPT P10636 8/20 0.55
LMNA P02545 4/20 0.55
KDM4E B2RXH2 4/20 0.52
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
HTT P42858 5/20 0.46
MT-CO1 P00395 1/20 0.44
MT-CO2 P00403 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
GFER P55789 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NOD2 Q9HC29 1/20 0.43
APAF1 O14727 1/20 0.43
TDP2 O95551 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP2C19 P33261 2/20 0.42

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
SCHEMBL23403596 0.94 GAA (0.57) GAAALOX15MAPTLMNAKDM4E
SCHEMBL23402525 0.93 GAA (0.46) GAAALOX15MAPTLMNAKDM4E
SCHEMBL23403225 0.91 GAA (0.64) GAAALOX15MAPTLMNAKDM4E
SCHEMBL23401540 0.88 MAPT (0.49) GAAALOX15MAPTLMNAKDM4E
SCHEMBL23399044 0.85 MAPT (0.55) GAAALOX15MAPTLMNAKDM4E
SCHEMBL23398935 0.83 KDM4E (0.47) GAAALOX15MAPTLMNAKDM4E
SCHEMBL23403117 0.83 GAA (0.55) GAAALOX15MAPTLMNAKDM4E
SCHEMBL23398713 0.82 GAA (0.84) GAAALOX15MAPTLMNAKDM4E
SCHEMBL23401851 0.81 GAA (0.62) GAAALOX15MAPTLMNAKDM4E
SCHEMBL23401133 0.79 GAA (0.65) GAAALOX15MAPTLMNAKDM4E

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