SCHEMBL8778664

SCHEMBL8778664

CC(C)(Cc1cc(C(=O)O)ccc1C(=O)O)c1cc(C(=O)O)ccc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.43
ACE2 Q9BYF1 3/20 0.42
MYC P01106 1/20 0.41
KDM4E B2RXH2 2/20 0.41
POLB P06746 3/20 0.39
MEN1 O00255 1/20 0.39
APEX1 P27695 1/20 0.39
KMT2A Q03164 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TSHR P16473 1/20 0.39
EPHX2 P34913 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
RARB P10826 1/20 0.37
RARG P13631 1/20 0.37
NR1H4 Q96RI1 4/20 0.37
RXRB P28702 3/20 0.37
RXRA P19793 2/20 0.37
RXRG P48443 1/20 0.37
PTPN1 P18031 1/20 0.37
CA12 O43570 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
SCHEMBL1618045 0.84 TDP1 (0.46) TDP1ACE2MYCKDM4EPOLB
SCHEMBL8050752 0.83 POLB (0.46) TDP1ACE2MYCKDM4EPOLB
Ethylene SCHEMBL9718947 0.81 TDP1 (0.44) TDP1ACE2MYCKDM4EPOLB
SCHEMBL10566065 0.78 ESR1 (0.46) TDP1MYCPOLBTSHREPHX2
SCHEMBL6309093 0.78 TDP1 (0.50) TDP1ACE2MYCKDM4EPOLB
SCHEMBL1355541 0.78 TDP1 (0.54) TDP1ACE2MYCKDM4EPOLB
SCHEMBL23519696 0.78 TDP1 (0.41) TDP1ACE2MYCKDM4EPOLB
SCHEMBL4543961 0.77 KDM4E (0.44) TDP1ACE2MYCKDM4EPOLB
SCHEMBL125461 0.77 TDP1 (0.49) TDP1ACE2MYCKDM4EPOLB
SCHEMBL8459721 0.77 ACE2 (0.51) TDP1ACE2MYCKDM4EPOLB

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-0583743-B1 Process for the production of monomeric terephthalic acid diesters and diols from polyesters HOECHST AG (DE) 1997-01-15 EP disclosed
EP-0583743-A2 Process for the production of monomeric terephthalic acid diesters and diols from polyesters HOECHST AKTIENGESELLSCHAFT (DE) 1994-02-23 EP disclosed