SCHEMBL4066495

SCHEMBL4066495

CCCCCCc1cn(CCCCCC)c(C)n1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 11/20 0.48
KCNH2 Q12809 1/20 0.46
MIF P14174 1/20 0.41
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
GABRA2 P47869 1/20 0.38
GABRB2 P47870 1/20 0.38
CYP19A1 P11511 4/20 0.37

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
Hydrochloric Acid SCHEMBL16990774 0.98 TLR8 (0.50) TLR8KCNH2MIFALDH1A1POLB
Bromide SCHEMBL8750325 0.98 TLR8 (0.47) TLR8KCNH2MIFALDH1A1POLB
SCHEMBL5330185 0.85 TLR8 (0.62) TLR8KCNH2KMT2ACYP19A1
SCHEMBL5327329 0.85 TLR8 (0.62) TLR8KCNH2KMT2ACYP19A1
SCHEMBL5817976 0.85 TLR8 (0.62) TLR8KCNH2KMT2ACYP19A1
SCHEMBL5291621 0.85 TLR8 (0.62) TLR8KCNH2KMT2ACYP19A1
SCHEMBL5812202 0.85 TLR8 (0.62) TLR8KCNH2KMT2ACYP19A1
SCHEMBL5331832 0.85 TLR8 (0.62) TLR8KCNH2KMT2ACYP19A1
SCHEMBL5816660 0.85 TLR8 (0.62) TLR8KCNH2KMT2ACYP19A1
SCHEMBL5327018 0.85 TLR8 (0.62) TLR8KCNH2KMT2ACYP19A1

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
WO-2009024312-A2 METHOD FOR THE PRODUCTION AND STABILIZATION OF FUNCTIONAL METAL NANOPARTICLES IN IONIC LIQUIDS ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2009-02-26 WO disclosed