SCHEMBL7337235

SCHEMBL7337235

O=c1c2ccc(O)cc2oc2ccc(O)cc12

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.77
ESR2 Q92731 3/20 0.72
MGAM O43451 1/20 0.65
FASN P49327 1/20 0.65
KDM4E B2RXH2 6/20 0.63
MAPT P10636 4/20 0.63
HSD17B10 Q99714 4/20 0.63
ALDH1A1 P00352 4/20 0.63
ALOX15 P16050 2/20 0.63
LMNA P02545 1/20 0.63
HTT P42858 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
ESR1 P03372 2/20 0.62
PDE2A O00408 1/20 0.59
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
CYP3A4 P08684 3/20 0.56
CYP2C9 P11712 2/20 0.56
HPGD P15428 2/20 0.56
CASP1 P29466 2/20 0.56

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
SCHEMBL31423805 1.00 MAOA (0.77) MAOAESR2MGAMFASNKDM4E
SCHEMBL30468736 0.92 MAOA (0.81) MAOAESR2MGAMKDM4EMAPT
SCHEMBL1983479 0.92 MAOA (0.81) MAOAESR2MGAMKDM4EMAPT
Euxanthone SCHEMBL2161295 0.92 MAOA (0.81) MAOAESR2MGAMFASNKDM4E
SCHEMBL21327540 0.88 MAOA (0.66) MAOAESR2MGAMFASNKDM4E
SCHEMBL9246804 0.88 MAOA (0.66) MAOAESR2MGAMFASNKDM4E
SCHEMBL11728080 0.88 MAOA (0.66) MAOAESR2MGAMFASNKDM4E
SCHEMBL2299504 0.87 MAOA (1.00) MAOAESR2MGAMKDM4EMAPT
SCHEMBL1675981 0.87 MAOA (1.00) MAOAESR2MGAMFASNKDM4E
SCHEMBL29715739 0.87 MAOA (1.00) MAOAESR2MGAMKDM4EMAPT

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
US-5981774-A PREPARING 3,5-DI(2,3-EPOXYPROPOXY)-1-HYDROXYXANTHONE BY REACTING 1,3,5-TRIMETHOXYXANTHONE WITH HYDROGEN IODIDE IN PHENOL WHEREBY 1,3,5-TRIHYDROXYXANTHONE IS OBTAINED, REACTING PRODUCT WITH EPICHLOROHYDRIN IN POTASSIUM HYDROXIDE NATIONAL SCIENCE COUNCIL (TW) 1999-11-09 US disclosed
US-5741813-A ADMINISTERING SUBSTITUTED XANTHONES NATIONAL SCIENCE COUNCIL (TW) 1998-04-21 US disclosed
US-5495005-A ANTICOAGULANTS, CARDIOVASCULAR DISORDERS NATIONAL SCIENCE COUNCIL (TW) 1996-02-27 US disclosed