SCHEMBL23402190

SCHEMBL23402190

Cc1ccc(-c2c(-c3cccc(C)c3)[nH]n(-c3ccc(C)cc3)c2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH3 Q96Q83 1/20 0.49
GAA P10253 6/20 0.49
ALOX15 P16050 1/20 0.49
MAPT P10636 10/20 0.45
MEN1 O00255 7/20 0.45
KMT2A Q03164 7/20 0.45
HTT P42858 3/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NOD2 Q9HC29 2/20 0.45
CRHBP P24387 1/20 0.45
CRHR2 Q13324 1/20 0.45
HPGD P15428 1/20 0.41
PPARG P37231 1/20 0.41
NCOA2 Q15596 1/20 0.41
NCOA1 Q15788 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL23401708 0.96 GAA (0.55) ALKBH3GAAALOX15MAPTMEN1
SCHEMBL23399410 0.95 GAA (0.57) ALKBH3GAAALOX15MAPTMEN1
SCHEMBL23401079 0.93 MAPT (0.50) ALKBH3GAAALOX15MAPTMEN1
SCHEMBL23398844 0.90 GAA (0.61) ALKBH3GAAALOX15MAPTMEN1
SCHEMBL23399053 0.87 MAPT (0.52) ALKBH3GAAALOX15MAPTMEN1
SCHEMBL23402367 0.87 GAA (0.60) ALKBH3GAAALOX15MAPTMEN1
SCHEMBL23402162 0.87 GAA (0.60) ALKBH3GAAALOX15MAPTMEN1
SCHEMBL23399908 0.87 GAA (0.50) ALKBH3GAAALOX15MAPTMEN1
SCHEMBL23401672 0.86 ALKBH3 (0.56) ALKBH3GAAALOX15MAPTMEN1
SCHEMBL23402880 0.85 GAA (0.62) ALKBH3GAAALOX15MAPTMEN1

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