SCHEMBL8999909

SCHEMBL8999909

O=C(O)c1ccc(-c2cccc(-c3cccc(-c4ccc(C(=O)O)c(C(=O)O)c4)c3)c2)cc1C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 7/20 0.66
HNF4A P41235 2/20 0.59
MCL1 Q07820 2/20 0.59
DHFR P00374 1/20 0.59
KDM4E B2RXH2 1/20 0.54
GFER P55789 1/20 0.54
KMT2A Q03164 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
KMO O15229 1/20 0.52
DCLRE1B Q9H816 3/20 0.52
DCLRE1A Q6PJP8 1/20 0.52
XDH P47989 1/20 0.50
SLC22A12 Q96S37 1/20 0.50
ALDH1A1 P00352 1/20 0.50
ALOX15 P16050 1/20 0.50
PTPN1 P18031 1/20 0.49
CDC25B P30305 2/20 0.48
CDC25A P30304 1/20 0.48
HSD17B10 Q99714 1/20 0.48
ATM Q13315 1/20 0.48

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
SCHEMBL1099041 1.00 ACMSD (0.66) ACMSDHNF4AMCL1DHFRKDM4E
SCHEMBL30605782 1.00 ACMSD (0.66) ACMSDHNF4AMCL1DHFRKDM4E
SCHEMBL29395437 1.00 ACMSD (0.66) ACMSDHNF4AMCL1DHFRKDM4E
Benzene SCHEMBL3623695 0.93 KMT2A (0.60) ACMSDHNF4AMCL1DHFRKDM4E
SCHEMBL28279304 0.91 ACMSD (0.67) ACMSDHNF4AMCL1DHFRKMO
SCHEMBL30365332 0.91 ACMSD (0.67) ACMSDHNF4AMCL1DHFRKMO
SCHEMBL68982 0.91 ACMSD (0.70) ACMSDHNF4AMCL1DHFRKDM4E
SCHEMBL30616786 0.91 ACMSD (0.70) ACMSDHNF4AMCL1DHFRKDM4E
SCHEMBL30690398 0.91 KMT2A (0.62) ACMSDHNF4AMCL1DHFRKDM4E
SCHEMBL30690397 0.91 KMT2A (0.62) ACMSDHNF4AMCL1DHFRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5578697-A DIELECTRIC POLYMERS FOR ELECTRONICS KABUSHIKI KAISHA TOSHIBA (JP) 1996-11-26 US disclosed