SCHEMBL4264045

SCHEMBL4264045

BC(CC)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.39
CA4 P22748 1/20 0.39
TSHR P16473 1/20 0.36
KCNA3 P22001 1/20 0.36
CHRNB2 P17787 2/20 0.35
CHRNB4 P30926 2/20 0.35
CHRNA3 P32297 2/20 0.35
CHRNA7 P36544 2/20 0.35
CHRNA4 P43681 2/20 0.35
CA5A P35218 1/20 0.34
CA5B Q9Y2D0 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RIPK1 Q13546 1/20 0.33
TP53 P04637 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL1453725 0.74 LTA4H (0.40) LTA4HCA4TSHRKCNA3CHRNB2
SCHEMBL3081094 0.74 LTA4H (0.40) LTA4HCA4TSHRKCNA3CHRNB2
SCHEMBL9816269 0.74 LTA4H (0.40) LTA4HCA4TSHRKCNA3CHRNB2
SCHEMBL183720 0.74 LTA4H (0.40) LTA4HCA4TSHRKCNA3CHRNB2
SCHEMBL10083749 0.73 LTA4H (0.39) LTA4HCA4TSHRKCNA3CHRNB2
SCHEMBL11253530 0.73 LTA4H (0.39) LTA4HCA4TSHRKCNA3CHRNB2
SCHEMBL9541482 0.73 PPARG (0.39) LTA4HCA4TSHRKCNA3CHRNB2
SCHEMBL9910049 0.73 LTA4H (0.39) LTA4HCA4TSHRKCNA3CHRNB2
SCHEMBL2569849 0.73 LTA4H (0.39) LTA4HCA4TSHRKCNA3CHRNB2
SCHEMBL12160201 0.73 LTA4H (0.39) LTA4HCA4TSHRKCNA3CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8399570-B2 Functionalized polymers and improved tires therefrom BRIDGESTONE CORPORATION (JP) 2013-03-19 US disclosed
US-20090326161-A1 FUNCTIONALIZED POLYMERS AND IMPROVED TIRES THEREFROM BRIDGESTONE CORPORATION (JP) 2009-12-31 US disclosed
US-7598322-B1 particularly tire treads exhibiting reduced rolling resistance; a vulcanized rubbery polymer such as polybutadiene-butadiene-styrene copolymer made from living polymerization using butyllithium initiator and a tributyloxyborane as polymerization terminator BRIDGESTONE CORPORATION (JP) 2009-10-06 US disclosed