SCHEMBL24372040

SCHEMBL24372040

Cc1cc(CN)cc(C)c1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.51
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LOXL2 Q9Y4K0 1/20 0.45
TSHR P16473 1/20 0.44
LMNA P02545 2/20 0.44
GAA P10253 2/20 0.44
POLB P06746 1/20 0.44
FFAR4 Q5NUL3 1/20 0.43
PTPN1 P18031 1/20 0.43
HTR1A P08908 1/20 0.43
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
HPGD P15428 2/20 0.43
LIPE Q05469 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAOA P21397 1/20 0.42

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
SCHEMBL9362724 0.84 MAOB (0.52) MAOBMAPTL3MBTL1MAPK1TDP1
SCHEMBL14291457 0.84 TSHR (0.49) MAOBMAPTL3MBTL1MAPK1TDP1
SCHEMBL10481838 0.83 MAPT (0.50) MAOBMAPTL3MBTL1MAPK1TDP1
SCHEMBL5793118 0.82 FFAR4 (0.47) MAOBMAPTL3MBTL1MAPK1TDP1
SCHEMBL5795904 0.82 L3MBTL1 (0.46) MAOBMAPTL3MBTL1MAPK1TDP1
SCHEMBL7535983 0.81 LMNA (0.53) MAOBMAPTL3MBTL1MAPK1TDP1
SCHEMBL1143540 0.81 MAOB (0.53) MAOBMAPTL3MBTL1MAPK1TDP1
SCHEMBL348875 0.80 MEN1 (0.55) MAOBMAPTL3MBTL1MAPK1TDP1
SCHEMBL8555303 0.80 KDM1A (0.49) MAOBMAPTL3MBTL1MAPK1TDP1
SCHEMBL13403395 0.79 LMNA (0.45) MAOBMAPTL3MBTL1MAPK1TDP1

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-3988561-A1 PREPARATION AND USE OF REACTIVE OXYGEN SPECIES SCAVENGER XWPharma Ltd. (KY) 2022-04-27 EP disclosed