SCHEMBL9211542

SCHEMBL9211542

c1ccc(Oc2ccc(-c3ccc(Oc4ccccc4)c(-c4ccccc4)c3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GSTP1 P09211 1/20 0.56
▸ NCOA1 Q15788 1/20 0.51
▸ NCOA3 Q9Y6Q9 1/20 0.51
▸ PTGS2 P35354 1/20 0.45
▸ LTA4H P09960 4/20 0.44
▸ TSHR P16473 1/20 0.44
▸ FFAR4 Q5NUL3 3/20 0.43
▸ HTR2A P28223 1/20 0.43
▸ SLC6A4 P31645 1/20 0.43
▸ FFAR1 O14842 1/20 0.43
▸ TTR P02766 1/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ SLC6A9 P48067 1/20 0.41
▸ NR1H2 P55055 1/20 0.41
▸ BAX Q07812 1/20 0.41
▸ MAOA P21397 1/20 0.41
▸ SCN9A Q15858 1/20 0.40
▸ BRD4 O60885 1/20 0.40

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
SCHEMBL9217384 0.96 GSTP1 (0.50) GSTP1NCOA1NCOA3PTGS2LTA4H
SCHEMBL11818436 0.95 GSTP1 (0.51) GSTP1NCOA1NCOA3PTGS2LTA4H
SCHEMBL11815327 0.95 GSTP1 (0.51) GSTP1NCOA1NCOA3PTGS2LTA4H
SCHEMBL11821442 0.93 GSTP1 (0.54) GSTP1NCOA1NCOA3PTGS2LTA4H
SCHEMBL11815013 0.93 GSTP1 (0.49) GSTP1NCOA1NCOA3PTGS2LTA4H
SCHEMBL11818921 0.93 GSTP1 (0.49) GSTP1NCOA1NCOA3PTGS2LTA4H
SCHEMBL11817781 0.93 GSTP1 (0.53) GSTP1NCOA1NCOA3PTGS2LTA4H
SCHEMBL11818603 0.92 NCOA1 (0.49) GSTP1NCOA1NCOA3PTGS2FFAR4
SCHEMBL11824406 0.91 GSTP1 (0.51) GSTP1NCOA1NCOA3PTGS2LTA4H
SCHEMBL11820028 0.89 GSTP1 (0.49) GSTP1NCOA1NCOA3PTGS2FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5464569-A In situ formation of alkali metal oxalates in polyphenylene ether basestock MONSANTO COMPANY (US) 1995-11-07 — — US disclosed
US-5439614-A Colloidal dispersion of aromatic ether and oxidation inhibiting amount of alkali metal salt of oxalic acid MONSANTO COMPANY (US) 1995-08-08 — — US disclosed
US-4143077-A BROMINATING, THEN IODINATING M-TERPHENYL, ETHERIFYING WITH AN ALKALI METAL PHENOLATE INSTITUT FRANCAIS DU PETROLE (FR) 1979-03-06 — — US disclosed
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