SCHEMBL7284747

SCHEMBL7284747

CCOc1ccc(OC)c2[nH]cc(C(=O)OC(C)OCC)c(=O)c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ KDM4E B2RXH2 4/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CLEC4M Q9H2X3 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ HIF1A Q16665 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MAPK1 P28482 1/20 0.33
▸ LMNA P02545 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL7284753 0.79 CLEC4M (0.43) CNR1CNR2KDM4EALDH1A1HPGD
SCHEMBL9829849 0.78 CLEC4M (0.56) CNR1CNR2KDM4EALDH1A1HPGD
SCHEMBL7291074 0.74 CLEC4M (0.50) CNR1CNR2KDM4ECLEC4MMAPT
SCHEMBL7291947 0.73 CLEC4M (0.54) CNR1CNR2KDM4EALDH1A1HPGD
SCHEMBL62162 0.71 CLEC4M (0.52) CNR1CNR2KDM4EALDH1A1HPGD
SCHEMBL10839866 0.70 KDM4E (0.65) CNR1CNR2KDM4EALDH1A1HPGD
SCHEMBL397393 0.69 CLEC4M (0.52) CNR1CNR2KDM4EALDH1A1HPGD
SCHEMBL7291746 0.68 CLEC4M (0.51) CNR1CNR2KDM4EALDH1A1HPGD
SCHEMBL2432859 0.66 ADORA3 (0.43) KDM4EALDH1A1HPGDMAPTCYP3A4
SCHEMBL7284683 0.66 CYP1A2 (0.59) KDM4EALDH1A1HPGDCLEC4MMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0343574-B1 4(1H)-quinolone derivatives KIRIN BREWERY (JP) 1994-07-27 — — EP claimed
EP-0343574-B1 4(1H)-quinolone derivatives KIRIN BREWERY (JP) 1994-07-27 — — EP disclosed
US-5081121-A Cardiotonic agents KIRIN BEER KABUSHIKI KAISHA (JP) 1992-01-14 — — US disclosed
EP-0343574-A1 4(1H)-quinolone derivatives KIRIN BEER KABUSHIKI KAISHA (JP) 1989-11-29 — — EP disclosed
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