SCHEMBL6583469

SCHEMBL6583469

COc1cc(CC=CCCC2OCCO2)ccc1OCc1nc(-c2ccccc2)oc1C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.44
FFAR1 O14842 1/20 0.43
MAPT P10636 3/20 0.42
PPARG P37231 9/20 0.42
PPARA Q07869 7/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
PTGER4 P35408 1/20 0.41
PTGER2 P43116 1/20 0.41
PPARD Q03181 1/20 0.40
USP2 O75604 2/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL6582673 0.88 FFAR1 (0.49) KDRFFAR1MAPTPPARGPPARA
SCHEMBL6580905 0.86 PPARG (0.53) KDRFFAR1MAPTPPARGPPARA
SCHEMBL6584386 0.84 PPARG (0.49) KDRFFAR1MAPTPPARGPPARA
SCHEMBL6584539 0.84 PPARG (0.49) KDRFFAR1MAPTPPARGPPARA
SCHEMBL4038141 0.80 KDR (0.67) KDRFFAR1MAPTPPARGPPARA
SCHEMBL1731684 0.78 KDR (0.53) KDRFFAR1MAPTPPARGPPARA
SCHEMBL6583506 0.77 FFAR1 (0.52) KDRFFAR1MAPTPPARGPPARA
SCHEMBL4843985 0.77 FFAR1 (0.59) KDRFFAR1MAPTPPARGPPARA
SCHEMBL6587553 0.77 POLB (0.45) KDRFFAR1MAPTPPARGPPARA
SCHEMBL6587548 0.77 POLB (0.45) KDRFFAR1MAPTPPARGPPARA

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 3 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
US-5932601-A USEFUL FOR LOWERING BLOOD SUGAR AND LIPID IN BLOOD TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-08-03 US disclosed
EP-0710659-A1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-08 EP disclosed