SCHEMBL10482111

SCHEMBL10482111

C=CC(=O)OC(C)COC(=O)CCc1cc(-n2nnc3ccccc32)c(O)c(C(C)(C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.33
▸ MAOA P21397 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ GAA P10253 3/20 0.32
▸ KCNMA1 Q12791 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ ACHE P22303 1/20 0.31
▸ F2R P25116 1/20 0.30

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
SCHEMBL9227024 0.86 GAA (0.34) MAOBMAOAKMT2ANPC1RAB9A
SCHEMBL8466675 0.82 ALOX5 (0.38) MAOBMAOAKMT2ANPC1RAB9A
SCHEMBL1870426 0.81 MAOB (0.44) MAOBMAOAKMT2ANPC1RAB9A
SCHEMBL10394408 0.81 MAOB (0.38) MAOBMAOAKMT2AATMGAA
SCHEMBL8468557 0.78 MAOB (0.44) MAOBMAOAKMT2AATMGAA
SCHEMBL2777241 0.78 KCNMA1 (0.35) KMT2ANPC1RAB9AATMGAA
SCHEMBL9228497 0.77 GAA (0.35) MAOBMAOAKMT2ANPC1RAB9A
SCHEMBL10470440 0.76 MAOB (0.34) MAOBMAOAKMT2ANPC1RAB9A
SCHEMBL9230983 0.76 GAA (0.35) MAOBMAOAKMT2ANPC1RAB9A
SCHEMBL10482112 0.75 GAA (0.32) KMT2AGAAMEN1

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-4880859-A GROUP TRANSFER POLYMERIZATION, COATINGS CIBA-GEIGY CORPORATION (US) 1989-11-14 — — US disclosed
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