SCHEMBL8999945

SCHEMBL8999945

O=C(O)c1ccc(-c2cccc(Cc3cccc(-c4ccc(C(=O)O)c(C(=O)O)c4)c3)c2)cc1C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACMSD Q8TDX5 6/20 0.71
▸ BCL2 P10415 1/20 0.50
▸ HNF4A P41235 3/20 0.49
▸ MCL1 Q07820 2/20 0.49
▸ DHFR P00374 1/20 0.49
▸ PTPN1 P18031 3/20 0.47
▸ DCLRE1A Q6PJP8 1/20 0.47
▸ DCLRE1B Q9H816 1/20 0.47
▸ PTGER4 P35408 1/20 0.47
▸ PLA2G2A P14555 2/20 0.47
▸ PLA2G10 O15496 1/20 0.47
▸ PTPN5 P54829 1/20 0.47
▸ PTPN2 P17706 1/20 0.46
▸ PTPN6 P29350 1/20 0.46
▸ KLKB1 P03952 1/20 0.46
▸ CTSB P07858 1/20 0.46
▸ MMP9 P14780 1/20 0.46
▸ DNMT1 P26358 1/20 0.46
▸ DNMT3B Q9UBC3 1/20 0.46
▸ DNMT3L Q9UJW3 1/20 0.46

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
SCHEMBL30605782 0.85 ACMSD (0.66) ACMSDHNF4AMCL1DHFRPTPN1
SCHEMBL1099041 0.85 ACMSD (0.66) ACMSDHNF4AMCL1DHFRPTPN1
SCHEMBL29395437 0.85 ACMSD (0.66) ACMSDHNF4AMCL1DHFRPTPN1
SCHEMBL8999909 0.85 ACMSD (0.66) ACMSDHNF4AMCL1DHFRPTPN1
SCHEMBL9769824 0.83 ACMSD (1.00) ACMSDHNF4AMCL1DHFRPTPN1
SCHEMBL1563364 0.83 ACMSD (0.54) ACMSDHNF4AMCL1DHFRPTPN1
Benzene SCHEMBL3623695 0.82 KMT2A (0.60) ACMSDHNF4AMCL1DHFRPTPN1
SCHEMBL30616786 0.81 ACMSD (0.70) ACMSDHNF4AMCL1DHFRPTPN1
SCHEMBL68982 0.81 ACMSD (0.70) ACMSDHNF4AMCL1DHFRPTPN1
SCHEMBL30690397 0.80 KMT2A (0.62) ACMSDHNF4AMCL1DHFRDCLRE1A

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
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