SCHEMBL20044938

SCHEMBL20044938

CCCCc1cc(F)cc2cc3cc4cc5c(CCCC)cc(F)cc5cc4cc3cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.39
MPO P05164 3/20 0.34
ALOX5 P09917 4/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
TLR8 Q9NR97 2/20 0.33
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ERAP1 Q9NZ08 1/20 0.33
KDM4E B2RXH2 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
HCAR3 P49019 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31

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
SCHEMBL3465723 0.74 TLR8 (0.46) TYRALOX5TLR8MEN1TP53
SCHEMBL27861114 0.70 TLR8 (0.45) TLR8
SCHEMBL31307570 0.70 TLR8 (0.45) TLR8
SCHEMBL6737013 0.70 CYP2A6 (0.37) TYRALDH1A1GAATLR8MEN1
SCHEMBL6736893 0.70 TLR8 (0.39) TYRTLR8
SCHEMBL6731332 0.69 TLR8 (0.35) TYRALOX5TLR8
SCHEMBL6736312 0.69 CYP1A2 (0.40) TYRTLR8
SCHEMBL5103997 0.68 TYR (0.46) TYRMPOALOX5TLR8MEN1
SCHEMBL5680876 0.68 ALOX5 (0.47) TYRALOX5MEN1TP53CYP3A4
SCHEMBL285532 0.68 TLR8 (0.46) TLR8

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-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed
US-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed