SCHEMBL7103686

SCHEMBL7103686

CCN(CC)CCCC(C)C(N)N(CCO)CCO

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.33
PLA2G2A P14555 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
LMNA P02545 2/20 0.30
NPSR1 Q6W5P4 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
ADRA2A P08913 1/20 0.30
CHRM1 P11229 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
CHRM3 P20309 1/20 0.30
ADRA1D P25100 1/20 0.30
KCNH2 Q12809 1/20 0.30
TMEM97 Q5BJF2 1/20 0.30
CGAS Q8N884 1/20 0.30
ACE2 Q9BYF1 1/20 0.30
TLR9 Q9NR96 1/20 0.30
TLR7 Q9NYK1 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
SCHEMBL10873422 0.81 SPHK1 (0.44) PLA2G1BPLA2G2ALMNACYP1A2HSD17B10
SCHEMBL2845490 0.78 SIGMAR1 (0.35) SIGMAR1LMNANPSR1CHRM2CHRM4
SCHEMBL29881672 0.74 OPRM1 (0.41) PLA2G1BPLA2G2ASIGMAR1LMNANPSR1
SCHEMBL18283422 0.74 OPRM1 (0.41) PLA2G1BPLA2G2ASIGMAR1LMNANPSR1
SCHEMBL5787559 0.74 OPRM1 (0.41) PLA2G1BPLA2G2ASIGMAR1LMNANPSR1
SCHEMBL8625402 0.74 OPRM1 (0.41) PLA2G1BPLA2G2ASIGMAR1LMNANPSR1
SCHEMBL1147313 0.72 PLA2G1B (0.56) PLA2G1BPLA2G2ASIGMAR1NPSR1
SCHEMBL7103688 0.72 SIGMAR1 (0.32) PLA2G1BPLA2G2ASIGMAR1NPSR1CYP1A2
SCHEMBL23098374 0.71 SIGMAR1 (0.41) PLA2G1BPLA2G2ASIGMAR1LMNACHRM2
SCHEMBL417108 0.71 OPRM1 (0.50) PLA2G1BPLA2G2ASIGMAR1LMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1092737-B1 Catalyst composition for the production of a polyurethane resin, and method for producing a polyurethane resin TOSOH CORP (JP) 2003-09-24 EP disclosed