SCHEMBL5147452

SCHEMBL5147452

C=CC(=O)Oc1cccc(O)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.46
THRA P10827 1/20 0.46
TYMS P04818 1/20 0.40
ESR1 P03372 6/20 0.40
ESR2 Q92731 6/20 0.40
TRPA1 O75762 1/20 0.39
ATM Q13315 1/20 0.39
ACHE P22303 1/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
MAPT P10636 3/20 0.37
HSD17B10 Q99714 3/20 0.37
KDM4E B2RXH2 2/20 0.37
HPGD P15428 2/20 0.37
ALOX15 P16050 2/20 0.37
TP53 P04637 2/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX12 P18054 1/20 0.37

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
SCHEMBL4595586 0.84 POLB (0.51) THRBTHRATYMSACHEKMT2A
SCHEMBL31295365 0.84 HSD17B10 (0.45) THRBTHRATYMSESR1ESR2
SCHEMBL8070515 0.84 HSD17B10 (0.45) THRBTHRATYMSESR1ESR2
SCHEMBL218920 0.82 THRB (0.50) THRBTHRATYMSESR1ESR2
SCHEMBL29497650 0.82 THRB (0.50) THRBTHRATYMSESR1ESR2
SCHEMBL26041847 0.81 THRB (0.44) THRBTHRATYMSACHEKMT2A
SCHEMBL25501716 0.80 THRB (0.43) THRBTHRATYMSESR1ESR2
SCHEMBL1247160 0.80 KDM4E (0.51) THRBTHRAESR1TRPA1KMT2A
SCHEMBL220010 0.79 ESR1 (0.61) THRBTHRATYMSESR1ESR2
SCHEMBL28623003 0.79 THRB (0.39) THRBTHRATYMSTRPA1KMT2A

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-108101786-B Method for synthesizing phenoxyalkenyl ether compound by catalyzing palladium salt 西南大学 2020-09-22 CN disclosed
US-7220529-B2 Photopolymerizable composition and recording material using the same FUJIFILM CORPORATION (JP) 2007-05-22 US disclosed
US-20050186504-A1 Photopolymerizable composition and recording material using the same FUJI PHOTO FILM CO., LTD. 2005-08-25 US disclosed