SCHEMBL7833006

SCHEMBL7833006

COC(=O)c1ncccc1O.O=C(O)c1ncccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.55
EGLN2 Q96KS0 1/20 0.50
FTO Q9C0B1 1/20 0.50
KDM4E B2RXH2 6/20 0.49
ALDH1A1 P00352 3/20 0.49
TSHR P16473 2/20 0.49
MAPT P10636 2/20 0.49
ALOX15 P16050 2/20 0.49
CYP3A4 P08684 1/20 0.49
BLM P54132 1/20 0.49
AGER Q15109 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
LMNA P02545 1/20 0.44
TLR7 Q9NYK1 4/20 0.44

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
SCHEMBL108876 0.93 L3MBTL1 (0.62) L3MBTL1EGLN2FTOKDM4EALDH1A1
Hydrochloric Acid SCHEMBL6569637 0.91 L3MBTL1 (0.60) L3MBTL1EGLN2FTOKDM4EALDH1A1
Methyl Alcohol SCHEMBL28038357 0.86 KDM4E (0.59) L3MBTL1EGLN2FTOKDM4EALDH1A1
SCHEMBL78249 0.86 KDM4E (0.63) L3MBTL1EGLN2FTOKDM4EALDH1A1
SCHEMBL15312235 0.86 KDM4E (0.63) L3MBTL1EGLN2FTOKDM4EALDH1A1
SCHEMBL31356480 0.86 KDM4E (0.63) L3MBTL1EGLN2FTOKDM4EALDH1A1
SCHEMBL2273367 0.84 KDM4E (0.61) L3MBTL1EGLN2FTOKDM4EALDH1A1
SCHEMBL1985357 0.84 KDM4E (0.61) L3MBTL1EGLN2FTOKDM4EALDH1A1
SCHEMBL2277608 0.84 KDM4E (0.61) L3MBTL1EGLN2FTOKDM4EALDH1A1
SCHEMBL28568937 0.84 KDM4E (0.61) L3MBTL1EGLN2FTOKDM4EALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1162196-A1 FUSED-RING COMPOUNDS AND USE THEREOF AS DRUGS JAPAN TOBACCO INC. (JP) 2001-12-12 EP disclosed