SCHEMBL8409750

SCHEMBL8409750

Cc1cccc(/C=C/c2ccccc2)c1OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 7/20 0.56
PTGER3 P43115 7/20 0.56
PTGER2 P43116 7/20 0.56
PTGER1 P34995 6/20 0.56
NFE2L2 Q16236 2/20 0.49
LCK P06239 1/20 0.49
HTR1A P08908 2/20 0.45
ADRA1D P25100 2/20 0.45
ADRA1A P35348 2/20 0.45
ADRA1B P35368 2/20 0.45
MAOB P27338 2/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PPARG P37231 1/20 0.43
TRPA1 O75762 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
CYP1A1 P04798 1/20 0.41

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
SCHEMBL8406768 1.00 PTGER4 (0.56) PTGER4PTGER3PTGER2PTGER1NFE2L2
SCHEMBL1618631 0.82 NFE2L2 (0.49) PTGER4PTGER3PTGER2PTGER1NFE2L2
SCHEMBL2574855 0.81 PTGER4 (0.55) PTGER4PTGER3PTGER2PTGER1HTR1A
SCHEMBL16038777 0.81 PTGER3 (0.80) PTGER4PTGER3PTGER2PTGER1L3MBTL1
SCHEMBL16038779 0.81 PTGER3 (0.80) PTGER4PTGER3PTGER2PTGER1L3MBTL1
SCHEMBL16070265 0.81 PTGER3 (0.80) PTGER4PTGER3PTGER2PTGER1L3MBTL1
SCHEMBL8406368 0.81 LCK (0.46) PTGER4PTGER3PTGER2PTGER1NFE2L2
SCHEMBL8406052 0.81 LCK (0.48) PTGER4PTGER3PTGER2PTGER1NFE2L2
SCHEMBL8406054 0.81 LCK (0.48) PTGER4PTGER3PTGER2PTGER1NFE2L2
SCHEMBL18716386 0.80 HTR1A (0.61) PTGER4PTGER3PTGER2PTGER1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0778821-B1 ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF ZENECA LTD (GB) 1999-10-20 EP disclosed
US-5965741-A ANTIINFLAMMATORY, ANTIPYRETIC AND ANTIDIARRHOEAL PROPERTIES ZENECA LIMITED (GB) 1999-10-12 US disclosed
EP-0778821-A1 ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF ZENECA LIMITED (GB) 1997-06-18 EP disclosed
WO-1996006822-A1 ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF ZENECA LIMITED (GB) 1996-03-07 WO disclosed