SCHEMBL809788

SCHEMBL809788

CCCCCCCCC[N+]1=C2CCCCCN2CCC1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 5/20 0.35
NPC1 O15118 3/20 0.31
LMNA P02545 3/20 0.31
SLC2A1 P11166 3/20 0.31
RAB9A P51151 3/20 0.31
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
PAX8 Q06710 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
HTT P42858 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NTSR1 P30989 1/20 0.31
NPY5R Q15761 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL809918 1.00 CCR5 (0.35) CCR5NPC1LMNASLC2A1RAB9A
SCHEMBL810016 1.00 CCR5 (0.35) CCR5NPC1LMNASLC2A1RAB9A
SCHEMBL810033 1.00 CCR5 (0.35) CCR5NPC1LMNASLC2A1RAB9A
SCHEMBL809752 1.00 CCR5 (0.35) CCR5NPC1LMNASLC2A1RAB9A
SCHEMBL809578 1.00 CCR5 (0.35) CCR5NPC1LMNASLC2A1RAB9A
SCHEMBL809728 1.00 CCR5 (0.35) CCR5NPC1LMNASLC2A1RAB9A
SCHEMBL810056 1.00 CCR5 (0.35) CCR5NPC1LMNASLC2A1RAB9A
SCHEMBL810164 1.00 CCR5 (0.35) CCR5NPC1LMNASLC2A1RAB9A
SCHEMBL809978 1.00 CCR5 (0.35) CCR5NPC1LMNASLC2A1RAB9A
SCHEMBL809690 1.00 CCR5 (0.35) CCR5NPC1LMNASLC2A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2098567-B1 ACRYLIC RUBBER COMPOSITION AND VULCANIZATE THEREOF DENKI KAGAKU KOGYO KK (JP) 2011-11-16 EP disclosed
US-8012556-B2 Acrylic rubber composition and its vulcanized product DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2011-09-06 US disclosed
US-20100009105-A1 ACRYLIC RUBBER COMPOSITION AND VULCANIZED PRODUCT DENKI KAGAKU KIGYO KABUSHIKI KAISHA (JP) 2010-01-14 US disclosed
EP-2098567-A1 ACRYLIC RUBBER COMPOSITION AND VULCANIZATE THEREOF Denki Kagaku Kogyo Kabushiki Kaisha (JP) 2009-09-09 EP disclosed