SCHEMBL9216280

SCHEMBL9216280

c1ccc(Oc2cccc(Oc3cc(Oc4ccccc4)ccc3Oc3ccccc3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
ALDH1A1 P00352 2/20 0.54
MITF O75030 1/20 0.54
GAA P10253 1/20 0.54
MAPT P10636 1/20 0.54
GFER P55789 1/20 0.54
NLRP1 Q9C000 1/20 0.54
NOD2 Q9HC29 1/20 0.54
LTA4H P09960 3/20 0.52
TSHR P16473 1/20 0.52
MAOB P27338 1/20 0.52
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
NLRP3 Q96P20 1/20 0.47
AKR1C3 P42330 1/20 0.47
NR1H2 P55055 1/20 0.46
BAX Q07812 1/20 0.46
MAOA P21397 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
SCHEMBL11576951 0.93 LTA4H (0.55) MEN1KMT2ASMN1; SMN2ALDH1A1MITF
SCHEMBL9216146 0.91 ALDH1A1 (0.58) MEN1KMT2ASMN1; SMN2ALDH1A1MITF
SCHEMBL9217514 0.91 ALDH1A1 (0.58) MEN1KMT2ASMN1; SMN2ALDH1A1MITF
SCHEMBL11820817 0.89 LTA4H (0.60) MEN1KMT2ASMN1; SMN2ALDH1A1MITF
SCHEMBL3890642 0.89 LTA4H (0.60) MEN1KMT2ASMN1; SMN2ALDH1A1MITF
SCHEMBL1173713 0.89 LTA4H (0.60) MEN1KMT2ASMN1; SMN2ALDH1A1MITF
SCHEMBL10756879 0.89 LTA4H (0.60) MEN1KMT2ASMN1; SMN2ALDH1A1MITF
SCHEMBL10761453 0.89 LTA4H (0.60) MEN1KMT2ASMN1; SMN2ALDH1A1MITF
SCHEMBL11851238 0.89 LTA4H (0.60) MEN1KMT2ASMN1; SMN2ALDH1A1MITF
SCHEMBL4025823 0.89 LTA4H (0.60) MEN1KMT2ASMN1; SMN2ALDH1A1MITF

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-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 claimed
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