SCHEMBL3674376

SCHEMBL3674376

O=C(Nc1ccc(I)cc1)c1ccc(I)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.76
NPC1 O15118 3/20 0.63
RAB9A P51151 3/20 0.63
MEN1 O00255 2/20 0.63
POLB P06746 2/20 0.63
KMT2A Q03164 2/20 0.63
LMNA P02545 1/20 0.63
PKM P14618 1/20 0.63
APEX1 P27695 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
KDM4E B2RXH2 2/20 0.59
GAA P10253 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
PTPN1 P18031 4/20 0.57
TP53 P04637 1/20 0.57
ALOX15 P16050 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
HIF1A Q16665 2/20 0.56
EPAS1 Q99814 2/20 0.56
MITF O75030 1/20 0.55

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
SCHEMBL31053876 0.92 MITF (0.68) TRPV1NPC1RAB9AMEN1POLB
SCHEMBL10439291 0.92 TRPV1 (0.67) TRPV1NPC1RAB9AMEN1POLB
SCHEMBL1991606 0.90 TRPV1 (0.65) TRPV1NPC1RAB9AMEN1KMT2A
SCHEMBL21258508 0.90 RAB9A (0.81) TRPV1NPC1RAB9AMEN1KMT2A
SCHEMBL4618184 0.90 TRPV1 (0.65) TRPV1NPC1RAB9AMEN1KMT2A
SCHEMBL30799065 0.90 PTPN1 (0.73) TRPV1NPC1RAB9AMEN1POLB
SCHEMBL5718666 0.90 PTPN1 (0.71) TRPV1NPC1RAB9AMEN1POLB
SCHEMBL2564907 0.90 PTPN1 (0.71) TRPV1NPC1RAB9AMEN1POLB
SCHEMBL6515702 0.89 TRPV1 (0.69) TRPV1NPC1RAB9AMEN1POLB
SCHEMBL7302186 0.87 HDAC3 (0.73) TRPV1NPC1RAB9AMEN1KMT2A

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
EP-1329444-B1 Halogenated aromatic compound, (co)polymer thereof, and proton-conductive membrane comprising same JSR CORP (JP) 2010-05-05 EP disclosed
US-6933068-B2 Polymer electrolyte membrane and solid polymer electrolyte fuel cell using same HONDA GIKEN KOGYO KABUSHIKI KAISHA (JP) 2005-08-23 US disclosed
US-6833426-B2 A proton-conductive membrane containing the sulfonic acid group-containing polyarylene (co)polymer JSR CORPORATION (JP) 2004-12-21 US disclosed
US-20030173547-A1 Halogenated aromatic compound, (co)polymer thereof, and proton-conductive membrane comprising same JSR CORPORATION (JP) 2003-09-18 US disclosed
EP-1329444-A1 Halogenated aromatic compound, (co)polymer thereof, and proton-conductive membrane comprising same JSR Corporation (JP) 2003-07-23 EP disclosed
US-20020172850-A1 Polymer electrolyte membrane and solid polymer electrolyte fuel cell using same HONDA GIKEN KOGYO KABUSHIKI KAISHA, JSR CORPORATION 2002-11-21 US disclosed