SCHEMBL10561640

SCHEMBL10561640

Cc1cccc(-c2coc3c(O)c(O)ccc3c2=O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 6/20 1.00
▸ ALOX12 P18054 6/20 1.00
▸ PIK3CA P42336 5/20 0.73
▸ XDH P47989 1/20 0.63
▸ PFKFB3 Q16875 1/20 0.63
▸ ABCB1 P08183 1/20 0.60
▸ KDM4E B2RXH2 3/20 0.55
▸ GAA P10253 2/20 0.55
▸ RECQL P46063 2/20 0.55
▸ CA12 O43570 2/20 0.53
▸ CA9 Q16790 2/20 0.53
▸ MAPT P10636 3/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ POLB P06746 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TP53 P04637 1/20 0.46

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
SCHEMBL10560725 0.84 ALOX15 (1.00) ALOX15ALOX12PIK3CAXDHPFKFB3
SCHEMBL10564854 0.84 ALOX15 (0.73) ALOX15ALOX12PIK3CAXDHPFKFB3
SCHEMBL10561728 0.83 ALOX15 (1.00) ALOX15ALOX12PIK3CAXDHPFKFB3
SCHEMBL10562974 0.83 ALOX15 (1.00) ALOX15ALOX12PIK3CAXDHPFKFB3
SCHEMBL10562125 0.82 ALOX15 (0.71) ALOX15ALOX12PIK3CAXDHPFKFB3
SCHEMBL29482685 0.82 XDH (0.76) ALOX15ALOX12PIK3CAXDHPFKFB3
SCHEMBL17938839 0.82 XDH (0.76) ALOX15ALOX12PIK3CAXDHPFKFB3
SCHEMBL10564082 0.81 ALOX15 (1.00) ALOX15ALOX12PIK3CAXDHPFKFB3
SCHEMBL28705298 0.80 ALOX15 (0.73) ALOX15ALOX12PIK3CAXDHPFKFB3
SCHEMBL2072028 0.79 ALOX15 (0.65) ALOX15ALOX12PIK3CAXDHPFKFB3

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
US-4814346-A Benzopyrans and use thereof in treating vascular diseases ZYMA SA (CH) 1989-03-21 — — US disclosed
EP-0267155-A2 Bicyclic compounds Zyma SA (CH) 1988-05-11 — — EP disclosed
Send feedback