SCHEMBL8114019

SCHEMBL8114019

Cc1ccnc2c1ccc1cccnc12.[O-][I+3]([O-])([O-])O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 6/20 0.81
CCR8 P51685 6/20 0.81
L3MBTL1 Q9Y468 6/20 0.81
CCR5 P51681 4/20 0.81
MAPT P10636 5/20 0.50
LMNA P02545 4/20 0.50
KDM4E B2RXH2 4/20 0.50
HTT P42858 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HSP90AA1 P07900 2/20 0.50
MMP2 P08253 2/20 0.50
TSHR P16473 2/20 0.50
GMNN O75496 1/20 0.50
TP53 P04637 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
MMP9 P14780 1/20 0.50
ALOX15 P16050 1/20 0.50
NFKB1 P19838 1/20 0.50

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
SCHEMBL912010 0.90 CCR1 (1.00) CCR1CCR8L3MBTL1CCR5MAPT
SCHEMBL8069300 0.89 CCR1 (0.96) CCR1CCR8L3MBTL1CCR5MAPT
SCHEMBL8114923 0.87 CCR1 (0.75) CCR1CCR8L3MBTL1CCR5LMNA
Phenanthroline SCHEMBL8119708 0.83 CCR1 (0.73) CCR1CCR8L3MBTL1CCR5MAPT
SCHEMBL8112817 0.83 CCR1 (0.81) CCR1CCR8L3MBTL1CCR5MAPT
SCHEMBL182930 0.75 CCR1 (1.00) CCR1CCR8L3MBTL1CCR5LMNA
SCHEMBL29563986 0.75 CCR1 (1.00) CCR1CCR8L3MBTL1CCR5LMNA
Phenanthroline SCHEMBL21518505 0.75 CCR1 (0.93) CCR1CCR8L3MBTL1CCR5MAPT
SCHEMBL8114394 0.74 HSP90AA1 (0.76) CCR1CCR8L3MBTL1CCR5MAPT
Oxyquinoline SCHEMBL2787814 0.73 HTT (0.70) CCR1CCR8L3MBTL1CCR5MAPT

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-0546563-B1 Complex crystal TOYOTA MOTOR CO LTD (JP) 2000-11-08 EP claimed
EP-0546563-A2 Complex crystal TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 1993-06-16 EP claimed
EP-0546563-B1 Complex crystal TOYOTA MOTOR CO LTD (JP) 2000-11-08 EP disclosed
US-5710273-A AND AN ANION OF TRIIODINE AND AN ACID, LIGHT ADJUSTING COMPONENT FOR AUTOMOBILE WINDSHIELDS TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 1998-01-20 US disclosed
US-5646284-A AUTOMOBILE WINDSHIELDS THAT SCREEN LIGHT TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 1997-07-08 US disclosed
EP-0546563-A2 Complex crystal TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 1993-06-16 EP disclosed