SCHEMBL28636752

SCHEMBL28636752

CCCCc1cc(CC(C)c2cc(CCCC)c(O)c(CCCC)c2)cc(CCCC)c1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.39
ALOX5 P09917 5/20 0.37
HTT P42858 2/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
EGFR P00533 1/20 0.37
PTGS2 P35354 6/20 0.36
CYP3A4 P08684 3/20 0.34
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL9636655 0.84 GABRA1 (0.46) TYRALOX5HTTNPC1HPGD
SCHEMBL8037388 0.84 TYR (0.42) TYRALOX5HTTNPC1HPGD
SCHEMBL8370068 0.79 EGFR (0.41) TYRALOX5HTTNPC1HPGD
SCHEMBL30416291 0.79 SHBG (0.44) ESR1ESR2TP53MAPTTSHR
SCHEMBL201692 0.78 NPC1 (0.57) TYRALOX5HTTNPC1HPGD
SCHEMBL27803636 0.77 TYR (0.42) TYRALOX5HTTNPC1HPGD
SCHEMBL8517221 0.77 EGFR (0.43) TYRALOX5HTTNPC1HPGD
SCHEMBL6314093 0.76 HTT (0.50) TYRALOX5HTTNPC1HPGD
SCHEMBL28215541 0.76 NPC1 (0.55) TYRALOX5HTTNPC1HPGD
SCHEMBL28031372 0.76 NPC1 (0.55) TYRALOX5HTTNPC1HPGD

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
CN-113166470-A Method for stabilizing virgin thermoplastic materials and stabilized plastic compositions, molding compounds and moldings produced therefrom, stabilizer composition and use thereof 弗劳恩霍夫应用研究促进协会 2021-07-23 CN disclosed