SCHEMBL6587331

SCHEMBL6587331

COc1cc(/C=C/C=C/C(=O)O)ccc1OCc1nc(-c2ccccc2)oc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
KDM4E B2RXH2 4/20 0.49
ALDH1A1 P00352 2/20 0.48
FFAR1 O14842 1/20 0.47
CA2 P00918 2/20 0.47
CA5A P35218 2/20 0.47
CA9 Q16790 2/20 0.47
APP P05067 3/20 0.46
KDR P35968 1/20 0.46
RECQL P46063 1/20 0.46
PTGER4 P35408 1/20 0.46
PTGER3 P43115 1/20 0.46
PTGER2 P43116 1/20 0.46
SNCA P37840 1/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL6587340 1.00 MAPT (0.49) MAPTKDM4EALDH1A1FFAR1CA2
SCHEMBL6583466 0.89 MAPT (0.47) MAPTKDM4EALDH1A1FFAR1APP
SCHEMBL6583468 0.89 MAPT (0.47) MAPTKDM4EALDH1A1FFAR1APP
SCHEMBL6583243 0.88 TRPA1 (0.48) MAPTKDM4EALDH1A1FFAR1APP
SCHEMBL6583241 0.88 TRPA1 (0.48) MAPTKDM4EALDH1A1FFAR1APP
SCHEMBL6583665 0.88 KDR (0.49) MAPTKDM4EALDH1A1FFAR1APP
SCHEMBL6583671 0.88 KDR (0.49) MAPTKDM4EALDH1A1FFAR1APP
SCHEMBL6157314 0.85 ALDH1A1 (0.54) MAPTKDM4EALDH1A1FFAR1KDR
SCHEMBL6583866 0.84 MAPT (0.48) MAPTKDM4EALDH1A1FFAR1KDR
SCHEMBL6970790 0.84 FFAR1 (0.62) MAPTKDM4EFFAR1KDRPPARG

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-0710659-B1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-01-28 EP disclosed
EP-0710659-A1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-08 EP disclosed