SCHEMBL4272376

SCHEMBL4272376

O=C(O)CCc1cc(I)c(OCc2cccc(Br)c2)c(I)c1

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 11/20 0.77
THRB P10828 11/20 0.77
ESR1 P03372 1/20 0.77
NR3C1 P04150 1/20 0.77
PGR P06401 1/20 0.77
NR3C2 P08235 1/20 0.77
AR P10275 1/20 0.77
FFAR1 O14842 6/20 0.67
FFAR4 Q5NUL3 4/20 0.67
PCNA P12004 2/20 0.52
AKR1B1 P15121 1/20 0.47
POLB P06746 1/20 0.47
MAPK1 P28482 1/20 0.47
HIF1A Q16665 1/20 0.47
HCAR2 Q8TDS4 1/20 0.47

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
SCHEMBL4273581 0.87 THRA (0.57) THRATHRBESR1NR3C1PGR
SCHEMBL4898980 0.87 THRA (1.00) THRATHRBESR1NR3C1PGR
SCHEMBL4271148 0.87 THRA (0.57) THRATHRBESR1NR3C1PGR
SCHEMBL4269700 0.86 FFAR1 (0.70) THRATHRBESR1NR3C1PGR
SCHEMBL4266556 0.85 FFAR1 (0.63) THRATHRBESR1NR3C1PGR
SCHEMBL4271200 0.83 MRGPRX4 (0.59) THRATHRBESR1NR3C1PGR
SCHEMBL1998296 0.80 FFAR1 (1.00) THRATHRBESR1NR3C1PGR
SCHEMBL4887059 0.80 THRB (0.80) THRATHRBESR1NR3C1PGR
SCHEMBL4280680 0.80 FFAR1 (0.60) THRATHRBESR1NR3C1PGR
SCHEMBL4898421 0.80 THRA (0.77) THRATHRBESR1NR3C1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2066362-A1 RADIOPAQUE AMIDE POLYMERS AND MEDICAL DEVICES FORMED THEREOF Boston Scientific Limited (BB) 2009-06-10 EP claimed
WO-2008033198-A1 RADIOPAQUE AMIDE POLYMERS AND MEDICAL DEVICES FORMED THEREOF BOSTON SCIENTIFIC LIMITED (BB) 2008-03-20 WO claimed
US-20080064848-A1 Radiopaque amide polymers and medical devices formed thereof BOSTON SCIENTIFIC SCIMED, INC. (US) 2008-03-13 US claimed
US-6638977-B1 Biaryl and benzyl ethers and thioethers CORVAS INTERNATIONAL, INC. 2003-10-28 US claimed
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 WO claimed
US-8507639-B2 Polyamide block polymers containing iodoarylcarboxyl pendant groups and modified poly(meth)acrylamide; coupling; for tracking movement of a catheter through the body or inflation of balloon at site BOSTON SCIENTIFIC SCIMED, INC. (US) 2013-08-13 US disclosed
EP-2066362-A1 RADIOPAQUE AMIDE POLYMERS AND MEDICAL DEVICES FORMED THEREOF Boston Scientific Limited (BB) 2009-06-10 EP disclosed
WO-2008033198-A1 RADIOPAQUE AMIDE POLYMERS AND MEDICAL DEVICES FORMED THEREOF BOSTON SCIENTIFIC LIMITED (BB) 2008-03-20 WO disclosed
US-20080064848-A1 Radiopaque amide polymers and medical devices formed thereof BOSTON SCIENTIFIC SCIMED, INC. (US) 2008-03-13 US disclosed
US-6677473-B1 TREATMENT, PREVENTION OR AMELIORATION OF ONE OR MORE SYMPTOMS OF THROMBOTIC DISORDERS, UNSTABLE ANGINA OR CANCER CORVAS INTERNATIONAL INC 2004-01-13 US disclosed
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 WO disclosed