SCHEMBL9340368

SCHEMBL9340368

CC(c1ccccc1)c1cccc(C(C)c2ccccc2)c1[O]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.47
DAO P14920 1/20 0.40
TAAR1 Q96RJ0 2/20 0.38
KMT2A Q03164 3/20 0.37
MAPT P10636 3/20 0.37
MEN1 O00255 1/20 0.37
CYP2C9 P11712 1/20 0.37
ACP3 P15309 1/20 0.37
LMNA P02545 3/20 0.37
KDM4E B2RXH2 2/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2C P18825 1/20 0.37
CYP2D6 P10635 1/20 0.37
HIF1A Q16665 1/20 0.37
PTGS1 P23219 2/20 0.36
PTGS2 P35354 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CXCR1 P25024 1/20 0.36
CXCR2 P25025 1/20 0.36
RECQL P46063 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
SCHEMBL9343232 0.86 TYR (0.47) TYRDAOTAAR1KMT2AMAPT
SCHEMBL4658430 0.85 TYR (0.54) TYRTAAR1KMT2AMAPTMEN1
SCHEMBL4156669 0.83 TYR (0.48) TYRDAOTAAR1KMT2AMAPT
SCHEMBL3161235 0.79 GABRA1 (0.56) TYRKMT2AMAPTMEN1CYP2C9
SCHEMBL25195570 0.79 TYR (0.46) TYRTAAR1KMT2ALMNAKDM4E
SCHEMBL3819120 0.78 TYR (0.48) TYRTAAR1KMT2AMAPTMEN1
SCHEMBL29358402 0.77 ADRA2A (0.47) TYRCYP2C9ACP3ADRA2AADRA2C
SCHEMBL945031 0.77 TYR (0.44) TYRDAOTAAR1KMT2AMAPT
SCHEMBL29639058 0.77 TYR (0.44) TYRTAAR1KMT2AMAPTMEN1
SCHEMBL29639057 0.77 TYR (0.44) TYRTAAR1KMT2AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0280938-B1 Antioxidant aromatic fluorophosphites ETHYL CORP (US) 1994-06-15 EP disclosed
EP-0280938-A1 Antioxidant aromatic fluorophosphites ALBEMARLE CORPORATION (US) 1988-09-07 EP disclosed