SCHEMBL8073969

SCHEMBL8073969

CCCCOc1c(O)c2ccc(OC)cc2oc1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 3/20 0.62
KDM4E B2RXH2 7/20 0.52
ALDH1A1 P00352 7/20 0.52
MAPT P10636 5/20 0.52
RAB9A P51151 3/20 0.52
NPC1 O15118 2/20 0.52
POLB P06746 1/20 0.52
STAT1 P42224 1/20 0.52
HPGD P15428 5/20 0.51
HSD17B10 Q99714 4/20 0.51
GAA P10253 1/20 0.51
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 2/20 0.48
CYP2C19 P33261 1/20 0.48
MEN1 O00255 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
CASP1 P29466 1/20 0.48

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
SCHEMBL8485055 0.96 NQO1 (0.58) NQO1KDM4EALDH1A1MAPTRAB9A
SCHEMBL7620708 0.96 NQO1 (0.58) NQO1KDM4EALDH1A1MAPTRAB9A
SCHEMBL8489509 0.90 ALDH1A1 (0.57) NQO1KDM4EALDH1A1MAPTRAB9A
SCHEMBL8081637 0.90 NQO1 (0.59) NQO1KDM4EALDH1A1MAPTRAB9A
SCHEMBL8489307 0.90 NQO1 (0.65) NQO1KDM4EALDH1A1MAPTRAB9A
SCHEMBL8495123 0.89 MAOA (0.54) NQO1KDM4EALDH1A1MAPTRAB9A
SCHEMBL8486987 0.89 MAOA (0.54) NQO1KDM4EALDH1A1MAPTRAB9A
SCHEMBL6274722 0.88 MAP1LC3B (0.51) NQO1KDM4EALDH1A1MAPTRAB9A
SCHEMBL6273108 0.88 MAP1LC3B (0.51) NQO1KDM4EALDH1A1MAPTRAB9A
SCHEMBL6276622 0.87 MAP1LC3B (0.57) NQO1KDM4EALDH1A1MAPTHPGD

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
CN-1101678-C Benzopyran derivative and therapeutic agent for heart disease containing the same as active ingredient DAINIPPON INK & CHEMICALS (JP) 2003-02-19 CN disclosed
EP-0684255-B1 7-Glycosyloxybenzopyran derivative and antiallergic agent containing the derivative as active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-10-11 EP disclosed
US-5981495-A TREATING HEART DISEASE BY ADMINISTERING TO THE HEART PATIENT A BENOPYRAN DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-11-09 US disclosed
CN-1164999-A Benzopyran derivative and therapeutic agent for heart disease containing the same as active ingredient DAINIPPON INK & CHEMICALS (JP) 1997-11-19 CN disclosed
EP-0796854-A1 Benzopyran derivative and use of said benzopyran derivative for treating heart disease DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-09-24 EP disclosed
EP-0684255-A1 7-Glycosyloxybenzopyran derivative and antiallergic agent containing the derivative as active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1995-11-29 EP disclosed