SCHEMBL28075813

SCHEMBL28075813

CCCCc1cc(SSSc2cc(CCCC)c(O)c(CCCC)c2)cc(CCCC)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.43
ALOX5 P09917 6/20 0.41
PTGS2 P35354 6/20 0.40
EGFR P00533 1/20 0.40
HTT P42858 3/20 0.37
MAPK1 P28482 2/20 0.37
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.37
CYP3A4 P08684 2/20 0.37
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 3/20 0.36
GAA P10253 2/20 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
SCHEMBL28075204 0.92 TYR (0.46) TYRALOX5PTGS2EGFRHTT
SCHEMBL10933792 0.84 TYR (0.46) TYRALOX5PTGS2EGFRHTT
SCHEMBL11651473 0.80 PTGS2 (0.41) TYRALOX5PTGS2HTTMEN1
SCHEMBL12642360 0.79 MAPT (0.50) TYRALOX5PTGS2EGFRHTT
SCHEMBL14818255 0.78 ALOX5 (0.42) TYRALOX5PTGS2EGFRHTT
SCHEMBL199841 0.78 TYR (0.41) TYRALOX5PTGS2EGFRHTT
SCHEMBL5140860 0.77 TYR (0.50) TYRALOX5PTGS2EGFRHTT
SCHEMBL1760464 0.77 ALOX5 (0.61) TYRALOX5PTGS2EGFRHTT
SCHEMBL9744224 0.77 PTGS2 (0.51) TYRALOX5PTGS2EGFRHTT
SCHEMBL280118 0.75 TYR (0.48) TYRALOX5PTGS2EGFRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106232323-A Resin sheet, resin sheet with adhesive layer, and use of the same 日本合成化学工业株式会社 2016-12-14 CN disclosed
CN-103958607-B Fire retardant resin composition containing Merlon-polydiorganosiloxanepolyurea copolymer resins and products formed thereof 帝人株式会社 2016-10-12 CN disclosed
CN-105849143-A Radical curable composition, plastic sheet, plastic sheet roll, and molded product 日本合成化学工业株式会社 2016-08-10 CN disclosed