SCHEMBL9150680

SCHEMBL9150680

COC=C(C(=O)OC)c1ccccc1Oc1cc(Oc2ccccc2)ccc1C(C)=O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
RAB9A P51151 1/20 0.39
MAPK1 P28482 1/20 0.38
GFER P55789 1/20 0.38
PGR P06401 1/20 0.37
CTNNB1 P35222 1/20 0.37
KDM4E B2RXH2 2/20 0.36
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
POLB P06746 2/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PNLIP P16233 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.36
SIRT1 Q96EB6 1/20 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
SCHEMBL9150670 1.00 MEN1 (0.43) MEN1KMT2ARAB9AMAPK1GFER
SCHEMBL9151216 0.97 MEN1 (0.46) MEN1KMT2ARAB9AMAPK1CTNNB1
SCHEMBL9151229 0.97 MEN1 (0.46) MEN1KMT2ARAB9AMAPK1CTNNB1
SCHEMBL10390057 0.87 POLB (0.48) MEN1KMT2ARAB9AMAPK1GFER
SCHEMBL10390055 0.87 POLB (0.48) MEN1KMT2ARAB9AMAPK1GFER
SCHEMBL9150478 0.86 RAB9A (0.46) MEN1KMT2ARAB9APGRCTNNB1
SCHEMBL9150477 0.86 RAB9A (0.46) MEN1KMT2ARAB9APGRCTNNB1
SCHEMBL203716 0.84 CTNNB1 (0.51) MEN1KMT2ARAB9ACTNNB1KDM4E
SCHEMBL6932850 0.84 CTNNB1 (0.51) MEN1KMT2ARAB9ACTNNB1KDM4E
SCHEMBL29358669 0.84 CTNNB1 (0.51) MEN1KMT2ARAB9ACTNNB1KDM4E

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