SCHEMBL23401079

SCHEMBL23401079

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.50
GAA P10253 6/20 0.50
MEN1 O00255 6/20 0.50
KMT2A Q03164 6/20 0.50
HTT P42858 3/20 0.50
NOD2 Q9HC29 2/20 0.50
LMNA P02545 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
ALKBH3 Q96Q83 1/20 0.48
ALOX15 P16050 1/20 0.48
TNF P01375 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
NOD1 Q9Y239 1/20 0.45
ALKBH5 Q6P6C2 1/20 0.43
ALDH1A1 P00352 2/20 0.39
NPC1 O15118 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL23399053 0.94 MAPT (0.52) MAPTGAAMEN1KMT2AHTT
SCHEMBL23401513 0.93 ALKBH3 (0.56) MAPTGAAMEN1KMT2AHTT
SCHEMBL23401672 0.93 ALKBH3 (0.56) MAPTGAAMEN1KMT2AHTT
SCHEMBL23399410 0.93 GAA (0.57) MAPTGAAMEN1KMT2AHTT
SCHEMBL23402190 0.93 ALKBH3 (0.49) MAPTGAAMEN1KMT2AHTT
SCHEMBL23399450 0.93 GAA (0.58) MAPTGAAMEN1KMT2AHTT
SCHEMBL23401708 0.89 GAA (0.55) MAPTGAAMEN1KMT2AHTT
SCHEMBL23398844 0.89 GAA (0.61) MAPTGAAMEN1KMT2AHTT
SCHEMBL23401273 0.89 GAA (0.59) MAPTGAAMEN1KMT2AHTT
SCHEMBL23403130 0.85 GAA (0.68) MAPTGAAMEN1KMT2AHTT

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