SCHEMBL6833232

SCHEMBL6833232

CCCCCCCCCCn1ccnc1C(N)CCCC

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.55
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 2/20 0.46
POLB P06746 1/20 0.46
TDP1 Q9NUW8 1/20 0.38
ARG1 P05089 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
SLC2A1 P11166 1/20 0.36
TBXAS1 P24557 1/20 0.36
TLR7 Q9NYK1 1/20 0.34
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 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
SCHEMBL27831297 0.84 TLR8 (0.58) TLR8ALDH1A1KMT2APOLBTDP1
SCHEMBL28096522 0.83 ALDH1A1 (0.54) TLR8ALDH1A1KMT2APOLBARG1
Sulfuric Acid SCHEMBL29275071 0.82 TLR8 (0.49) TLR8ALDH1A1KMT2APOLBTDP1
Bromide SCHEMBL28096069 0.81 ALDH1A1 (0.53) TLR8ALDH1A1KMT2APOLBARG1
SCHEMBL28702194 0.81 TLR8 (0.41) TLR8ALDH1A1KMT2APOLBARG1
SCHEMBL18250324 0.81 TLR8 (0.57) TLR8ALDH1A1KMT2APOLBTDP1
SCHEMBL28078170 0.81 TLR8 (0.57) TLR8ALDH1A1KMT2APOLBTDP1
SCHEMBL5824074 0.81 TLR8 (0.57) TLR8ALDH1A1KMT2APOLBTDP1
SCHEMBL29137079 0.80 TLR8 (0.44) TLR8ALDH1A1KMT2APOLBSLC2A1
SCHEMBL25067265 0.79 TLR8 (0.59) TLR8ALDH1A1KMT2APOLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040208808-A1 Solvent extraction mixture comprising substituted imidazole or benzimidazole for the purification of groups of base metals BHP BILLITON SA LIMITED (ZA) 2004-10-21 US disclosed
WO-2002101101-A2 SOLVENT EXTRACTION MIXTURE COMPRISING SUBSTITUTED IMIDAZOLE OR BENZIMIDAZOLE FOR THE PURIFICATION OF BASE METALS BILLITON SA LIMITED (ZA) 2002-12-19 WO disclosed