SCHEMBL23398373

SCHEMBL23398373

CCCCc1c(CC(C)C)c(O)nn1-c1ccccc1C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 3/20 0.35
KDM4E B2RXH2 2/20 0.35
APLNR P35414 1/20 0.33
MAPK1 P28482 1/20 0.33
HSP90AA1 P07900 1/20 0.32
OXER1 Q8TDS5 1/20 0.32
CDC25B P30305 1/20 0.31
HSD11B1 P28845 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PLK1 P53350 1/20 0.31
THRB P10828 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GCGR P47871 1/20 0.31

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
SCHEMBL23399960 0.93 ALDH1A1 (0.37) L3MBTL1POLBALDH1A1MAPTKDM4E
SCHEMBL23401793 0.91 L3MBTL1 (0.37) L3MBTL1POLBALDH1A1MAPTKDM4E
SCHEMBL23401494 0.90 POLB (0.40) L3MBTL1POLBALDH1A1MAPTKDM4E
SCHEMBL23403680 0.87 POLB (0.39) L3MBTL1POLBALDH1A1MAPTKDM4E
SCHEMBL23399739 0.87 ALDH1A1 (0.39) L3MBTL1ALDH1A1MAPTKDM4EMAPK1
SCHEMBL23399672 0.87 POLB (0.39) L3MBTL1POLBALDH1A1MAPTKDM4E
SCHEMBL23399422 0.87 ALDH1A1 (0.40) L3MBTL1ALDH1A1MAPTKDM4EHSD11B1
SCHEMBL23401781 0.86 POLB (0.39) L3MBTL1POLBALDH1A1MAPTKDM4E
SCHEMBL23399742 0.85 ALDH1A1 (0.37) L3MBTL1POLBALDH1A1MAPTKDM4E
SCHEMBL23400811 0.84 POLB (0.38) L3MBTL1POLBALDH1A1MAPTKDM4E

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