SCHEMBL7042676

SCHEMBL7042676

Sc1cccc2cc(Oc3ccccc3)ccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.44
LTA4H P09960 3/20 0.43
TSHR P16473 1/20 0.43
GAA P10253 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
MITF O75030 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
GFER P55789 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NLRP1 Q9C000 1/20 0.41
NOD2 Q9HC29 1/20 0.41
AKR1C3 P42330 1/20 0.41
FLT3 P36888 1/20 0.40
RCE1 Q9Y256 1/20 0.40
NR1H2 P55055 1/20 0.39
BAX Q07812 1/20 0.39
MAOA P21397 1/20 0.39
CHEK1 O14757 1/20 0.39

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
SCHEMBL1402628 0.78 CYP1A2 (0.55)
SCHEMBL4402154 0.76 LTA4H (0.60) MAOBLTA4HTSHRGAAKMT2A
SCHEMBL29860094 0.76 LTA4H (0.60) MAOBLTA4HTSHRGAAKMT2A
SCHEMBL9789564 0.76 LTA4H (0.67) MAOBLTA4HTSHRGAAKMT2A
SCHEMBL8435209 0.75 SIRT2 (0.42) MAOBLTA4HTSHRGAAKMT2A
SCHEMBL15345314 0.75 MAOB (0.44) MAOBLTA4HGAAKMT2AMEN1
SCHEMBL3895815 0.73 LTA4H (0.71) MAOBLTA4HTSHRGAAKMT2A
SCHEMBL3893288 0.73 LTA4H (0.71) MAOBLTA4HTSHRGAAKMT2A
SCHEMBL3888963 0.73 LTA4H (0.71) MAOBLTA4HTSHRGAAKMT2A
SCHEMBL436010 0.73 LTA4H (0.71) MAOBLTA4HTSHRGAAKMT2A

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
EP-0950649-B1 A process for preparing oxyalkylene derivatives in the presence of phosphine oxides MITSUI CHEMICALS INC (JP) 2003-03-26 EP disclosed
US-6130346-A ESTERIFICATION, CARBONATION, SULFONATION, ETHERIFICATION MITSUI CHEMICALS, INC. (JP) 2000-10-10 US disclosed
EP-0950649-A1 A process for preparing oxyalkylene derivatives in the presence of phosphine oxides Mitsui Chemicals, Inc. (JP) 1999-10-20 EP disclosed