SCHEMBL4265723

SCHEMBL4265723

BCCCC(N(CCCC)CCCC)N(CCCC)CCCC

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.32
PLA2G2A P14555 1/20 0.32
DNM1 Q05193 5/20 0.32
TSHR P16473 1/20 0.30
THRB P10828 1/20 0.30
FDPS P14324 3/20 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
SCHEMBL4268208 0.91 FDPS (0.33) PLA2G1BPLA2G2AFDPS
SCHEMBL4263660 0.88 MMP1 (0.30)
SCHEMBL4264064 0.87 DNM1 (0.39) PLA2G1BPLA2G2ADNM1TSHRTHRB
SCHEMBL4265822 0.82 DNM1 (0.37) PLA2G1BPLA2G2ADNM1TSHRTHRB
SCHEMBL17430697 0.76 DNM1 (0.40) PLA2G1BPLA2G2ADNM1TSHRTHRB
SCHEMBL4413219 0.75 FDPS (0.36) FDPS
SCHEMBL283202 0.74 ALDH1A1 (0.39) PLA2G1BDNM1TSHR
SCHEMBL705999 0.71 PLA2G1B (0.30) PLA2G1BPLA2G2A
SCHEMBL708082 0.70 PLA2G1B (0.32) PLA2G1BPLA2G2A
SCHEMBL27032991 0.69 MMP1 (0.32) DNM1TSHR

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