SCHEMBL5749320

SCHEMBL5749320

CCCCCCc1cc2cc3c(O)c4cc5ccccc5cc4c(O)c3cc2cc1CCCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.50
LIPG Q9Y5X9 1/20 0.50
ALOX5 P09917 5/20 0.49
MAPT P10636 3/20 0.49
TYR P14679 2/20 0.49
CYP3A4 P08684 2/20 0.49
MEN1 O00255 1/20 0.49
TP53 P04637 1/20 0.49
ALOX15 P16050 1/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
KDM4E B2RXH2 1/20 0.46
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
CASP1 P29466 1/20 0.46

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
SCHEMBL5753759 0.91 ALOX5 (0.52) LIPGALOX5MAPTTYRCYP3A4
SCHEMBL6661787 0.89 TLR8 (0.56) TLR8LIPGALOX5MAPTTYR
SCHEMBL5010709 0.89 TLR8 (0.56) TLR8LIPGALOX5MAPTTYR
SCHEMBL11229645 0.89 TLR8 (0.59) TLR8LIPGALOX5MAPTTYR
SCHEMBL11227235 0.89 TLR8 (0.59) TLR8LIPGALOX5MAPTTYR
SCHEMBL687356 0.87 GPR84 (0.45) TLR8KDM4EALDH1A1GAAHPGD
SCHEMBL28046693 0.87 TLR8 (0.61) TLR8LIPGALOX5MAPTTYR
SCHEMBL543932 0.87 TLR8 (0.48) TLR8LIPGALOX5MAPTTYR
SCHEMBL9643304 0.83 MAPT (0.49) TLR8LIPGALOX5MAPTTYR
SCHEMBL543810 0.82 TLR8 (0.47) TLR8LIPGALOX5MAPTTYR

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
CN-1922123-A Polyacene compound and organic semiconductor thin film ASAHI CHEMICAL CORP (JP) 2007-02-28 CN disclosed
EP-1719749-A1 POLYACENE COMPOUND AND ORGANIC SEMICONDUCTOR THIN FILM Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2006-11-08 EP disclosed