SCHEMBL10994834

SCHEMBL10994834

O=C(O)c1coc2c(O)c(O)ccc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 6/20 0.59
▸ ALOX12 P18054 6/20 0.59
▸ XDH P47989 1/20 0.55
▸ PFKFB3 Q16875 1/20 0.55
▸ ATP1A1 P05023 2/20 0.53
▸ ATP1B1 P05026 2/20 0.53
▸ ATP1A3 P13637 2/20 0.53
▸ ATP1B2 P14415 2/20 0.53
▸ ATP1A2 P50993 2/20 0.53
▸ ATP1B3 P54709 2/20 0.53
▸ FXYD2 P54710 2/20 0.53
▸ ATP1A4 Q13733 2/20 0.53
▸ NUDT1 P36639 1/20 0.53
▸ PIK3CA P42336 5/20 0.52
▸ MAOB P27338 1/20 0.50
▸ HSP90AA1 P07900 1/20 0.49
▸ HSP90AB1 P08238 1/20 0.49
▸ KDM4E B2RXH2 3/20 0.48
▸ GAA P10253 2/20 0.48
▸ RECQL P46063 2/20 0.48

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
SCHEMBL11151168 0.85 ALOX15 (0.55) ALOX15ALOX12XDHPFKFB3ATP1A1
SCHEMBL11509778 0.79 MCL1 (0.46) ALOX15ALOX12XDHPFKFB3ATP1A1
SCHEMBL10562974 0.74 ALOX15 (1.00) ALOX15ALOX12XDHPFKFB3PIK3CA
SCHEMBL11510369 0.74 MAOB (0.59) MAOBKDM4EGAAMAPTMEN1
Acetic Acid SCHEMBL10883615 0.74 ALOX15 (0.51) ALOX15ALOX12XDHPFKFB3ATP1A1
SCHEMBL29951632 0.73 PTPN1 (0.56) ALOX15ALOX12XDHPFKFB3ATP1A1
SCHEMBL1306154 0.73 PTPN1 (0.56) ALOX15ALOX12XDHPFKFB3ATP1A1
SCHEMBL10562125 0.72 ALOX15 (0.71) ALOX15ALOX12XDHPFKFB3PIK3CA
SCHEMBL234354 0.72 ALOX15 (0.75) ALOX15ALOX12XDHPFKFB3ATP1A1
SCHEMBL28705298 0.71 ALOX15 (0.73) ALOX15ALOX12XDHPFKFB3ATP1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4546176-A 7-Carboxymethoxyphenylacetamido-3-cephem derivatives and antibacterial preparations containing the same EISAI CO., LTD. (JP) 1985-10-08 — — US disclosed
US-4415567-A A 7B-CHROMONE-3-CARBOXAMIDO-2-/4-HYDROXY PHENYL/ACETAMIDO-2-CEPHEM DERIVATIVE EISAI CO., LTD. (JP) 1983-11-15 — — US disclosed
US-4344944-A 7-α-methoxycephalosporin derivatives, and antibacterial drugs onctaining the same EISAI CO., LTD. (JP) 1982-08-17 — — US disclosed
US-4285941-A ANTIBIOTICS EISAI CO., LTD. (JP) 1981-08-25 — — US disclosed
US-4285940-A ANTIBIOTICS EISAI CO., LTD. (JP) 1981-08-25 — — US disclosed
US-4285939-A ANTIBIOTICS EISAI CO., LTD. (JP) 1981-08-25 — — US disclosed
Send feedback