SCHEMBL11560468

SCHEMBL11560468

O=C(Nc1nnn[nH]1)c1ccc(OCc2ccccc2)cc1OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MET P08581 12/20 0.52
SGMS2 Q8NHU3 3/20 0.49
NOX1 Q9Y5S8 1/20 0.48
GAA P10253 1/20 0.46
LRRK2 Q5S007 1/20 0.45
MAOB P27338 1/20 0.45

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
SCHEMBL11563381 0.93 LRRK2 (0.55) METSGMS2GAALRRK2
SCHEMBL11555954 0.92 LRRK2 (0.54) METSGMS2NOX1LRRK2
SCHEMBL11561500 0.83 LRRK2 (0.63) SGMS2LRRK2
SCHEMBL11563128 0.83 LRRK2 (0.63) SGMS2LRRK2
SCHEMBL11559856 0.80 LRRK2 (0.65) SGMS2LRRK2
SCHEMBL9826042 0.78 LRRK2 (0.40) SGMS2NOX1LRRK2
SCHEMBL8148681 0.78 NR1H4 (0.53) GAA
SCHEMBL9825949 0.77 PTPN1 (0.43) SGMS2NOX1LRRK2
SCHEMBL11237669 0.75 PDE2A (0.49)
SCHEMBL11556662 0.74 POLB (0.48)

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-4146631-A ANTIALLERGENS, RESPIRATORY DISORDERS MAY & BAKER LIMITED (GB) 1979-03-27 US disclosed