SCHEMBL8311797

SCHEMBL8311797

O=C(NC(C(=O)O)c1ccc(O)cc1)c1coc2cc(O)c(O)cc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 18/20 0.49
▸ ALOX15 P16050 1/20 0.48
▸ ALOX12 P18054 1/20 0.48
▸ MAOA P21397 3/20 0.44
▸ ADORA2B P29275 3/20 0.44
▸ YARS1 P54577 1/20 0.38
▸ ACHE P22303 1/20 0.38

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
SCHEMBL8122057 0.90 MAOB (0.48) MAOBALOX15ALOX12MAOAADORA2B
SCHEMBL8122069 0.90 MAOB (0.48) MAOBALOX15ALOX12MAOAADORA2B
SCHEMBL8621258 0.83 MAOB (0.48) MAOBALOX15ALOX12MAOAADORA2B
SCHEMBL11281619 0.81 MAOB (0.42) MAOBMAOAADORA2B
SCHEMBL11247457 0.79 MAOB (0.39) MAOBMAOAADORA2B
SCHEMBL9329500 0.76 MAOB (0.46) MAOBALOX15ALOX12MAOAADORA2B
SCHEMBL11360922 0.76 MAOB (0.43) MAOBMAOAADORA2BACHE
SCHEMBL11033235 0.74 MAPT (0.40) MAOB
SCHEMBL11249099 0.74 KDM4E (0.40) MAOBMAOA
SCHEMBL10682794 0.74 MAOB (0.35) MAOBALOX15ALOX12MAOAADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0093376-B2 1-Sulfo-2-azetidinone derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-04-07 — — EP disclosed
EP-0093376-B1 1-SULFO-2-AZETIDINONE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1990-03-21 — — EP disclosed
US-4782147-A ANTIBIOTIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-11-01 — — US disclosed
EP-0093376-A2 1-Sulfo-2-azetidinone derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1983-11-09 — — EP disclosed
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