SCHEMBL4272964

SCHEMBL4272964

O=C(O)c1cc(Br)c(OCc2cccc(I)c2)c(Br)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 7/20 0.52
THRB P10828 7/20 0.52
MRGPRX4 Q96LA9 6/20 0.52
ESR1 P03372 1/20 0.52
NR3C1 P04150 1/20 0.52
PGR P06401 1/20 0.52
NR3C2 P08235 1/20 0.52
AR P10275 1/20 0.52
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NR4A2 P43354 1/20 0.46
NPC1 O15118 1/20 0.46
MITF O75030 1/20 0.46
TP53 P04637 1/20 0.46
HPGD P15428 1/20 0.46
XBP1 P17861 1/20 0.46
NFKB1 P19838 1/20 0.46

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
SCHEMBL6720860 0.86 MRGPRX4 (0.56) MRGPRX4RXRARXRBRXRGMEN1
SCHEMBL4887098 0.86 THRA (0.69) THRATHRBMRGPRX4ESR1NR3C1
SCHEMBL4265967 0.86 F2 (0.49) MRGPRX4RXRARXRBRXRGMEN1
SCHEMBL29108936 0.85 THRA (0.66) THRATHRBMRGPRX4ESR1NR3C1
SCHEMBL6725117 0.84 RXRA (0.59) THRATHRBMRGPRX4RXRARXRB
SCHEMBL4362435 0.83 THRA (0.70) THRATHRBMRGPRX4ESR1NR3C1
SCHEMBL4898421 0.83 THRA (0.77) THRATHRBESR1NR3C1PGR
SCHEMBL6275582 0.81 THRA (0.47) THRATHRBMRGPRX4ESR1NR3C1
SCHEMBL4817169 0.80 THRA (0.51) THRATHRBESR1NR3C1PGR
SCHEMBL4271200 0.78 MRGPRX4 (0.59) THRATHRBMRGPRX4ESR1NR3C1

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 10 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-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