SCHEMBL5012407

SCHEMBL5012407

CCCCCCCCCCCCCCCCCCc1cc2cc3cc4cc5cc(Br)c(Br)cc5cc4cc3cc2cc1CCCCCCCCCCCCCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.42
TYR P14679 2/20 0.42
CYP3A4 P08684 2/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TLR8 Q9NR97 5/20 0.40
LIPG Q9Y5X9 1/20 0.39
PTGS2 P35354 6/20 0.38
KCNH2 Q12809 1/20 0.38
HTR2A P28223 1/20 0.36

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
SCHEMBL3110488 0.89 ALOX5 (0.48) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL733803 0.88 ALOX5 (0.37) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL28453738 0.87 ALOX5 (0.47) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL28460292 0.87 ALOX5 (0.47) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL28468210 0.85 ALOX5 (0.44) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL16672054 0.84 ALOX5 (0.37) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL543501 0.82 ALOX5 (0.41) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL3465723 0.80 TLR8 (0.46) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL6661787 0.80 TLR8 (0.56) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL5010709 0.80 TLR8 (0.56) ALOX5TYRCYP3A4MEN1TP53

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-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed