SCHEMBL23401672

SCHEMBL23401672

Cc1ccc(-c2c(-c3ccccc3)[nH]n(-c3cccc(C)c3)c2=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH3 Q96Q83 3/20 0.56
MAPT P10636 9/20 0.55
GAA P10253 8/20 0.55
KMT2A Q03164 8/20 0.55
MEN1 O00255 7/20 0.55
HTT P42858 4/20 0.55
ALOX15 P16050 1/20 0.54
LMNA P02545 4/20 0.49
NOD2 Q9HC29 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CRHBP P24387 1/20 0.49
CRHR2 Q13324 1/20 0.49
TDP1 Q9NUW8 2/20 0.47
TNF P01375 1/20 0.47
NOD1 Q9Y239 1/20 0.47
ALKBH5 Q6P6C2 1/20 0.45
MAPK1 P28482 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 2/20 0.41

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
SCHEMBL23401513 1.00 ALKBH3 (0.56) ALKBH3MAPTGAAKMT2AMEN1
SCHEMBL23399053 0.96 MAPT (0.52) ALKBH3MAPTGAAKMT2AMEN1
SCHEMBL23401273 0.96 GAA (0.59) ALKBH3MAPTGAAKMT2AMEN1
SCHEMBL23401079 0.93 MAPT (0.50) ALKBH3MAPTGAAKMT2AMEN1
SCHEMBL23399410 0.92 GAA (0.57) ALKBH3MAPTGAAKMT2AMEN1
SCHEMBL23399450 0.92 GAA (0.58) ALKBH3MAPTGAAKMT2AMEN1
SCHEMBL23401133 0.90 GAA (0.65) ALKBH3MAPTGAAKMT2AMEN1
SCHEMBL23401531 0.90 GAA (0.65) ALKBH3MAPTGAAKMT2AMEN1
SCHEMBL23401851 0.89 GAA (0.62) ALKBH3MAPTGAAKMT2AMEN1
SCHEMBL23401708 0.88 GAA (0.55) ALKBH3MAPTGAAKMT2AMEN1

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