SCHEMBL6185423

SCHEMBL6185423

[O]CC(=O)NCc1ccc(O)cc1C(=O)NCCS(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 1/20 0.40
▸ SLC6A5 Q9Y345 5/20 0.36
▸ EGFR P00533 2/20 0.35
▸ SYK P43405 2/20 0.35
▸ ALOX5 P09917 2/20 0.35
▸ PTGS2 P35354 2/20 0.35
▸ MAOB P27338 2/20 0.35

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
SCHEMBL6619566 0.89 NAAA (0.40) NAAASLC6A5EGFRSYKALOX5
SCHEMBL6616584 0.79 EGLN1 (0.40) NAAASYK
SCHEMBL12608923 0.78 NAAA (0.62) NAAAEGFRSYKALOX5PTGS2
SCHEMBL6186618 0.77 CA12 (0.46) EGFRALOX5PTGS2
SCHEMBL6614575 0.71 ALDH1A1 (0.39) —
SCHEMBL4809608 0.69 ALDH1A1 (0.36) —
SCHEMBL12041029 0.66 NAAA (0.60) NAAAALOX5
SCHEMBL6264342 0.66 HPGD (0.49) SLC6A5
SCHEMBL17289507 0.65 HDAC1 (0.50) —
SCHEMBL17774845 0.65 ALOX5 (0.50) NAAAEGFRSYKALOX5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1521742-A1 DIPHENYLAZETIDINONE DERIVATIVES FOR TREATING DISORDERS OF THE LIPID METABOLISM AstraZeneca AB (SE) 2005-04-13 — — EP disclosed
WO-2004005247-A1 DIPHENYLAZETIDINONE DERIVATIVES FOR TREATING DISORDERS OF THE LIPID METABOLISM ASTRAZENECA AB (SE) 2004-01-15 — — WO disclosed
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