SCHEMBL23399241

SCHEMBL23399241

Cc1ccc(-c2c(O)nn(-c3cccc(C)c3)c2-c2cccc(C)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
RPA1 P27694 2/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
MAPT P10636 3/20 0.37
TP53 P04637 2/20 0.37
HPGD P15428 1/20 0.37
PPARG P37231 1/20 0.37
NCOA2 Q15596 1/20 0.37
NCOA1 Q15788 1/20 0.37
NPY5R Q15761 1/20 0.37
STAT1 P42224 1/20 0.36
RIPK2 O43353 1/20 0.36

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
SCHEMBL23400634 0.94 ALDH1A1 (0.43) ALDH1A1L3MBTL1RPA1KMT2AMEN1
SCHEMBL23400330 0.93 ALDH1A1 (0.48) ALDH1A1L3MBTL1RPA1KMT2AMEN1
SCHEMBL23399436 0.93 RPA1 (0.48) ALDH1A1L3MBTL1RPA1KMT2AMEN1
SCHEMBL23402024 0.93 RPA1 (0.48) ALDH1A1L3MBTL1RPA1KMT2AMEN1
SCHEMBL23398788 0.93 L3MBTL1 (0.50) ALDH1A1L3MBTL1RPA1KMT2AMEN1
SCHEMBL23401472 0.93 RPA1 (0.50) ALDH1A1L3MBTL1RPA1KMT2AMEN1
SCHEMBL23398921 0.89 L3MBTL1 (0.49) ALDH1A1L3MBTL1RPA1KMT2AMEN1
SCHEMBL23399608 0.89 RPA1 (0.51) ALDH1A1L3MBTL1RPA1KMT2AMEN1
SCHEMBL23398999 0.89 NPC1 (0.51) ALDH1A1L3MBTL1RPA1KMT2AMEN1
SCHEMBL23402373 0.85 ALDH1A1 (0.44) ALDH1A1L3MBTL1RPA1KMT2AMEN1

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