SCHEMBL8549448

SCHEMBL8549448

COc1cc(Oc2ccc(Cn3oc(=O)[nH]c3=O)cc2)cc(Oc2ccc(Cn3oc(=O)[nH]c3=O)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.45
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
PLAT P00750 5/20 0.42
CMA1 P23946 1/20 0.41
KDM4E B2RXH2 1/20 0.40
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
DAO P14920 1/20 0.39
FAAH O00519 1/20 0.38
MGLL Q99685 1/20 0.38
NPBWR1 P48145 1/20 0.38

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
SCHEMBL8550587 0.90 FFAR1 (0.47) FFAR1MEN1KMT2AALDH1A1MAPT
SCHEMBL8550945 0.89 FFAR1 (0.46) FFAR1MEN1KMT2AALDH1A1MAPT
SCHEMBL8546551 0.89 FFAR1 (0.46) FFAR1MEN1KMT2AALDH1A1MAPT
SCHEMBL8546158 0.88 PLAT (0.48) FFAR1MEN1KMT2AALDH1A1MAPT
SCHEMBL8546827 0.87 PLAT (0.42) FFAR1MEN1KMT2APLATDAO
SCHEMBL8544251 0.86 FFAR1 (0.48) FFAR1MEN1KMT2APLATDAO
SCHEMBL8549634 0.86 FFAR1 (0.43) FFAR1MEN1KMT2AALDH1A1MAPT
SCHEMBL8550204 0.83 PLAT (0.43) FFAR1MEN1KMT2APLATDAO
SCHEMBL8546486 0.83 ST14 (0.46) FFAR1MEN1KMT2AALDH1A1PLAT
SCHEMBL12578796 0.82 FFAR1 (0.58) FFAR1ALDH1A1MAPTPLATKDM4E

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-0696585-B1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMA CO LTD (JP) 1998-12-16 EP disclosed
US-5643931-A ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0696585-A1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 EP disclosed