SCHEMBL11076349

SCHEMBL11076349

CCOC(=O)C(=O)CC(=O)c1c(-c2ccc(OC)c(OC)c2)cc2ccccn12

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 5/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
ATM Q13315 1/20 0.49
MAPT P10636 9/20 0.47
ALDH1A1 P00352 6/20 0.47
KDM4E B2RXH2 5/20 0.47
HPGD P15428 3/20 0.47
MEN1 O00255 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
THRB P10828 1/20 0.43
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.37
TP53 P04637 1/20 0.37
SIRT3 Q9NTG7 1/20 0.37

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
SCHEMBL11075596 0.88 HTT (0.51) HTTL3MBTL1ATMMAPTALDH1A1
SCHEMBL11081349 0.88 MAPT (0.53) HTTL3MBTL1MAPTALDH1A1KDM4E
SCHEMBL11079986 0.86 L3MBTL1 (0.54) HTTL3MBTL1ATMMAPTALDH1A1
SCHEMBL11074876 0.86 THRB (0.58) HTTL3MBTL1ATMMAPTALDH1A1
SCHEMBL11078237 0.85 L3MBTL1 (0.50) HTTL3MBTL1ATMMAPTALDH1A1
SCHEMBL11076492 0.85 HTT (0.52) HTTL3MBTL1ATMMAPTALDH1A1
SCHEMBL11075441 0.85 L3MBTL1 (0.52) HTTL3MBTL1ATMMAPTALDH1A1
SCHEMBL11075739 0.83 L3MBTL1 (0.50) HTTL3MBTL1ATMMAPTALDH1A1
SCHEMBL11081793 0.82 L3MBTL1 (0.49) HTTL3MBTL1ATMMAPTALDH1A1
SCHEMBL11078060 0.82 L3MBTL1 (0.49) HTTL3MBTL1ATMMAPTALDH1A1

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
EP-0043858-B1 HETERO RING-SUBSTITUTED OXOALKANOIC ACID DERIVATIVES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1984-04-18 EP claimed
US-4386092-A IMMUNOMODULATORY YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1983-05-31 US claimed
EP-0043858-A1 HETERO RING-SUBSTITUTED OXOALKANOIC ACID DERIVATIVES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1982-01-20 EP claimed
EP-0043858-B1 HETERO RING-SUBSTITUTED OXOALKANOIC ACID DERIVATIVES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1984-04-18 EP disclosed
US-4386092-A IMMUNOMODULATORY YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1983-05-31 US disclosed
EP-0043858-A1 HETERO RING-SUBSTITUTED OXOALKANOIC ACID DERIVATIVES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1982-01-20 EP disclosed