SCHEMBL6764069

SCHEMBL6764069

CCCCCCCCc1cc(OC)ccc1OB(O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.46
MTNR1B P49286 3/20 0.46
ADRA1A P35348 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
ALOX5 P09917 5/20 0.45
PTGS2 P35354 3/20 0.44
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
LIPG Q9Y5X9 1/20 0.43
HTR2A P28223 1/20 0.43

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
SCHEMBL5861531 1.00 MTNR1A (0.46) MTNR1AMTNR1BADRA1ATAAR1ALOX5
SCHEMBL5859500 0.94 MTNR1A (0.48) MTNR1AMTNR1BADRA1ATAAR1
SCHEMBL10601156 0.85 ADRA1A (0.62) MTNR1AMTNR1BADRA1ATAAR1ALOX5
SCHEMBL10767997 0.85 ADRA1A (0.62) MTNR1AMTNR1BADRA1ATAAR1ALOX5
SCHEMBL5133668 0.85 ADRA1A (0.62) MTNR1AMTNR1BADRA1ATAAR1ALOX5
SCHEMBL9889155 0.83 ADRA1A (0.64) MTNR1AMTNR1BADRA1ATAAR1ALOX5
SCHEMBL5859440 0.82 LIPG (0.45) ALOX5PTGS2MEN1ALDH1A1KMT2A
SCHEMBL5858847 0.82 LIPG (0.45) ALOX5PTGS2MEN1ALDH1A1KMT2A
SCHEMBL28687663 0.80 LIPG (0.53) MTNR1AMTNR1BALOX5PTGS2LIPG
SCHEMBL28305336 0.79 LIPG (0.47) ALOX5PTGS2MEN1ALDH1A1KMT2A

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
US-20040142263-A1 Non-contact heat fixing toner KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. 2004-07-22 US disclosed