SCHEMBL9150477

SCHEMBL9150477

CO/C=C(/C(=O)OC)c1ccccc1Oc1cccc(Oc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.46
KDM4E B2RXH2 2/20 0.46
POLB P06746 1/20 0.46
CTNNB1 P35222 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 3/20 0.42
SIRT2 Q8IXJ6 1/20 0.42
SIRT1 Q96EB6 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
GAA P10253 3/20 0.42
TSHR P16473 2/20 0.42
MTNR1B P49286 1/20 0.42
PGR P06401 1/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPK8 P45983 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL9150478 1.00 RAB9A (0.46) RAB9AKDM4EPOLBCTNNB1MEN1
SCHEMBL10390057 0.99 POLB (0.48) RAB9AKDM4EPOLBCTNNB1MEN1
SCHEMBL10390055 0.99 POLB (0.48) RAB9AKDM4EPOLBCTNNB1MEN1
SCHEMBL9151752 0.94 POLB (0.51) RAB9AKDM4EPOLBMEN1KMT2A
SCHEMBL9151765 0.94 POLB (0.51) RAB9AKDM4EPOLBMEN1KMT2A
SCHEMBL29358669 0.93 CTNNB1 (0.51) RAB9AKDM4ECTNNB1MEN1KMT2A
SCHEMBL203716 0.93 CTNNB1 (0.51) RAB9AKDM4ECTNNB1MEN1KMT2A
SCHEMBL6932850 0.93 CTNNB1 (0.51) RAB9AKDM4ECTNNB1MEN1KMT2A
SCHEMBL9152513 0.93 KDM4E (0.42) RAB9AKDM4EPOLBCTNNB1MEN1
SCHEMBL9152526 0.93 KDM4E (0.42) RAB9AKDM4EPOLBCTNNB1MEN1

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-5468857-A Phenylmethoxypropenoic esters IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-11-21 US disclosed
US-5334748-A A methyl 2-aryl heterofunctional phenoxyphenyl-3-methoxy-propenoate compound; treating the plant diseases IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-08-02 US disclosed