SCHEMBL9622260

SCHEMBL9622260

COc1cc(OC)c2c(=O)c(O)c(-c3ccc(OC)c(OC)c3O)oc2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.69
CYP3A4 P08684 3/20 0.69
LMNA P02545 2/20 0.69
MAPT P10636 2/20 0.69
TP53 P04637 1/20 0.69
CASP1 P29466 1/20 0.69
CASP7 P55210 1/20 0.69
ABCG2 Q9UNQ0 7/20 0.68
ADORA3 P0DMS8 4/20 0.65
ABCB1 P08183 4/20 0.65
ABCC1 P33527 3/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
TDP1 Q9NUW8 2/20 0.60
ALDH1A1 P00352 1/20 0.60
MAPK1 P28482 1/20 0.60
SLC22A2 O15244 1/20 0.59
SLC22A1 O15245 1/20 0.59
DPP4 P27487 1/20 0.58
XDH P47989 1/20 0.58

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
SCHEMBL4147955 0.87 ABCG2 (0.67) KDM4ECYP3A4LMNAMAPTTP53
SCHEMBL30343500 0.86 ABCG2 (0.77) KDM4ECYP3A4LMNAMAPTTP53
SCHEMBL20981375 0.86 ABCG2 (0.77) KDM4ECYP3A4LMNAMAPTTP53
SCHEMBL16894641 0.84 ABCG2 (0.69) KDM4ECYP3A4LMNAMAPTTP53
SCHEMBL30037114 0.82 ADORA3 (0.79) KDM4ECYP3A4LMNAMAPTTP53
SCHEMBL16894653 0.82 ADORA3 (0.79) KDM4ECYP3A4LMNAMAPTTP53
SCHEMBL31412250 0.81 KDM4E (1.00) KDM4ECYP3A4LMNAMAPTTP53
SCHEMBL3135319 0.81 KDM4E (1.00) KDM4ECYP3A4LMNAMAPTTP53
SCHEMBL2629300 0.81 ABCG2 (1.00) KDM4ECYP3A4LMNAMAPTTP53
SCHEMBL4147950 0.81 ABCG2 (0.81) KDM4ECYP3A4LMNAMAPTTP53

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
US-5128429-A Low temperature block polymerization without randomization RAYCHEM LIMITED (GB) 1992-07-07 US disclosed
EP-0154506-B1 PREPARATION OF ORGANIC POLYMERS RAYCHEM LIMITED (GB) 1992-02-05 EP disclosed
US-4999411-A Polythioethers, polythiocarbonates, polythioamides, polythioimides RAYCHEM LIMITED (GB) 1991-03-12 US disclosed
US-4960835-A ENGINEERING THERMOPLASTICS RAYCHEM LIMITED (GB) 1990-10-02 US disclosed
US-4845179-A CONDENSATION POLYMERIZATION RAYCHEM LIMITED (GB) 1989-07-04 US disclosed
EP-0154506-A2 Preparation of organic polymers RAYCHEM LIMITED (GB) 1985-09-11 EP disclosed