SCHEMBL9343232

SCHEMBL9343232

CC(c1ccccc1)c1ccccc1[O]

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.47
DAO P14920 1/20 0.40
TAAR1 Q96RJ0 3/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
ACP3 P15309 1/20 0.37
CYP2D6 P10635 2/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2C P18825 1/20 0.37
LMNA P02545 1/20 0.37
HIF1A Q16665 1/20 0.37
KDM4E B2RXH2 1/20 0.37
SRC P12931 1/20 0.36
ALDH1A1 P00352 1/20 0.35
ALOX5 P09917 1/20 0.35

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
SCHEMBL9340368 0.86 TYR (0.47) TYRDAOTAAR1KMT2AMEN1
SCHEMBL4658430 0.85 TYR (0.54) TYRTAAR1KMT2AMEN1MAPT
SCHEMBL2544954 0.85 GABRA1 (0.40) KMT2AMEN1LMNAHIF1A
SCHEMBL4156669 0.78 TYR (0.48) TYRDAOTAAR1KMT2AMEN1
SCHEMBL3819120 0.78 TYR (0.48) TYRTAAR1KMT2AMEN1MAPT
SCHEMBL945031 0.77 TYR (0.44) TYRDAOTAAR1KMT2AMEN1
SCHEMBL9485194 0.77 TYR (0.57) TYRDAOTAAR1KMT2ACYP2D6
SCHEMBL710709 0.76 ACP3 (0.50) TYRTAAR1CYP2C9ACP3CYP2D6
SCHEMBL29638766 0.76 ACP3 (0.50) TYRTAAR1CYP2C9ACP3CYP2D6
SCHEMBL28666265 0.76 ACP3 (0.50) TYRTAAR1CYP2C9ACP3CYP2D6

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0407801-B1 Process for the preparation of phosphoraryl esters with alphamethylbenzylphenoxy groups BAYER AG (DE) 1994-09-07 EP claimed
EP-0407801-B1 Process for the preparation of phosphoraryl esters with alphamethylbenzylphenoxy groups BAYER AG (DE) 1994-09-07 EP disclosed
EP-0280938-B1 Antioxidant aromatic fluorophosphites ETHYL CORP (US) 1994-06-15 EP disclosed
EP-0407801-A1 Process for the preparation of phosphoraryl esters with alphamethylbenzylphenoxy groups BAYER AG (DE) 1991-01-16 EP disclosed
EP-0407801-A1 Process for the preparation of phosphoraryl esters with alphamethylbenzylphenoxy groups BAYER AG (DE) 1991-01-16 EP disclosed
EP-0280938-A1 Antioxidant aromatic fluorophosphites ALBEMARLE CORPORATION (US) 1988-09-07 EP disclosed