SCHEMBL7340588

SCHEMBL7340588

COc1cc(O)c(C(=O)c2ccccc2OC)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.59
CYP3A4 P08684 2/20 0.59
HPGD P15428 2/20 0.59
MAPT P10636 2/20 0.59
HSD17B10 Q99714 2/20 0.59
KDM4E B2RXH2 1/20 0.59
RECQL P46063 1/20 0.59
HTT P42858 3/20 0.58
IDO1 P14902 1/20 0.54
TDO2 P48775 1/20 0.54
HMGCR P04035 1/20 0.53
ALOX15 P16050 2/20 0.53
CYP1A2 P05177 1/20 0.53
PGR P06401 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
AR P10275 1/20 0.53
CHRM1 P11229 1/20 0.53
TBXA2R P21731 1/20 0.53
SLC6A2 P23975 1/20 0.53
CYP2C19 P33261 1/20 0.53

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
SCHEMBL322168 0.85 CTSD (0.62) LMNAHSD17B10HTTALOX15CHRM1
SCHEMBL29658169 0.85 CTSD (0.62) LMNAHSD17B10HTTALOX15CHRM1
SCHEMBL29229967 0.84 MAPT (0.70) LMNACYP3A4HPGDMAPTHSD17B10
SCHEMBL4060271 0.84 LMNA (0.62) LMNACYP3A4HPGDMAPTHSD17B10
SCHEMBL30320256 0.83 LMNA (0.62) LMNACYP3A4HPGDMAPTHSD17B10
SCHEMBL5709859 0.83 LMNA (0.62) LMNACYP3A4HPGDMAPTHSD17B10
SCHEMBL27789892 0.83 CTSD (0.60) LMNAHSD17B10HTTALOX15STS
Bicarbonate SCHEMBL10930728 0.83 LMNA (0.52) LMNACYP3A4HPGDMAPTHSD17B10
SCHEMBL9339940 0.83 MAPT (0.84) LMNACYP3A4HPGDMAPTHSD17B10
SCHEMBL3818697 0.83 KDM4E (0.59) LMNAHPGDHSD17B10KDM4EHTT

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