SCHEMBL23402185

SCHEMBL23402185

Cc1ccccc1-c1[nH]n(-c2ccccc2)c(=O)c1-c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 8/20 0.63
ALOX15 P16050 1/20 0.63
MAPT P10636 8/20 0.52
LMNA P02545 3/20 0.52
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
HTT P42858 4/20 0.50
TP53 P04637 2/20 0.50
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 2/20 0.44
MAPK1 P28482 1/20 0.44
GFER P55789 1/20 0.44
ALKBH3 Q96Q83 1/20 0.43
AURKA O14965 1/20 0.43
DAPK3 O43293 1/20 0.43
PDGFRA P16234 1/20 0.43
LTK P29376 1/20 0.43
GRK5 P34947 1/20 0.43

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
SCHEMBL23399443 0.93 GAA (0.55) GAAALOX15MAPTLMNAMEN1
SCHEMBL23398725 0.93 GAA (0.55) GAAALOX15MAPTLMNAMEN1
SCHEMBL23400771 0.90 MAPT (0.54) GAAALOX15MAPTLMNAMEN1
SCHEMBL23399944 0.89 MAPT (0.52) GAAALOX15MAPTLMNAMEN1
SCHEMBL23399857 0.87 GAA (0.47) GAAALOX15MAPTLMNAMEN1
SCHEMBL23402263 0.83 MAPT (0.53) GAAALOX15MAPTLMNAMEN1
SCHEMBL23399337 0.83 MAPT (0.53) GAAALOX15MAPTLMNAMEN1
SCHEMBL23401102 0.82 GAA (0.67) GAAALOX15MAPTLMNAMEN1
SCHEMBL23401597 0.82 KDM4E (0.46) GAAALOX15MAPTLMNAMEN1
SCHEMBL23401133 0.81 GAA (0.65) GAAALOX15MAPTLMNAMEN1

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