SCHEMBL9242543

SCHEMBL9242543

O=C(O)Oc1ccccc1C=Cc1ccccc1OC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.50
NFE2L2 Q16236 4/20 0.48
TFEB P19484 1/20 0.48
PTGER1 P34995 1/20 0.47
PTGER4 P35408 1/20 0.47
PTGER3 P43115 1/20 0.47
PTGER2 P43116 1/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
BCHE P06276 1/20 0.47
KDM4E B2RXH2 2/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.47
TRPA1 O75762 1/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
HSP90AA1 P07900 1/20 0.46
GAA P10253 2/20 0.44
SMN1; SMN2 Q16637 2/20 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
SCHEMBL8902287 1.00 HTT (0.50) HTTNFE2L2TFEBPTGER1PTGER4
SCHEMBL9244563 0.92 NFE2L2 (0.59) HTTNFE2L2TFEBPTGER1PTGER4
SCHEMBL14775182 0.88 MEN1 (0.50) HTTNFE2L2TFEBPTGER1PTGER4
SCHEMBL29445574 0.87 PTGDR2 (0.61) HTTNFE2L2TFEBLMNAMAPT
SCHEMBL6238224 0.87 PTGDR2 (0.61) HTTNFE2L2TFEBLMNAMAPT
SCHEMBL8900234 0.86 TRPA1 (0.49) HTTNFE2L2NPC1RAB9ALMNA
SCHEMBL2791739 0.83 PTGDR2 (0.44) HTTNFE2L2TFEBNPC1RAB9A
SCHEMBL8901021 0.82 NFE2L2 (0.56) HTTNFE2L2LMNABCHEKDM4E
SCHEMBL8902293 0.82 NFE2L2 (0.56) HTTNFE2L2LMNABCHEKDM4E
SCHEMBL143632 0.81 KDM4E (0.46) LMNAMAPTKDM4EPTGDR2KMT2A

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-0508264-B1 Process for the arylation of olefines BAYER AG (DE) 1995-04-26 EP disclosed
EP-0508264-A1 Process for the arylation of olefines BAYER AG (DE) 1992-10-14 EP disclosed