SCHEMBL8020546

SCHEMBL8020546

CC=C(Oc1cc(CC=NOCc2ccccc2)ccc1C)C(=O)OC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
CYP3A4 P08684 1/20 0.35
PTGER4 P35408 1/20 0.35
PTGER2 P43116 1/20 0.35
MTNR1A P48039 2/20 0.34
MTNR1B P49286 2/20 0.34
PKM P14618 2/20 0.34
MAPT P10636 2/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
PTPN1 P18031 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL8020542 0.92 ALDH1A1 (0.35) ALDH1A1KMT2AMEN1TDP1L3MBTL1
SCHEMBL8024516 0.85 PKM (0.34) KMT2AMEN1PKMNPC1RAB9A
SCHEMBL8022702 0.82 PTGS1 (0.35) ALDH1A1KMT2AMEN1TDP1L3MBTL1
SCHEMBL8020891 0.81 MAPT (0.41) ALDH1A1KMT2AMEN1TDP1L3MBTL1
SCHEMBL8024500 0.79 PPARG (0.46) L3MBTL1NPC1RAB9A
SCHEMBL26419875 0.78 FFAR1 (0.46) ALDH1A1KMT2AMEN1TDP1MTNR1A
SCHEMBL8206762 0.78 MEN1 (0.31) KMT2AMEN1TDP1L3MBTL1CYP3A4
SCHEMBL8024513 0.77 PKM (0.33) PKM
SCHEMBL8020920 0.74 ALDH1A1 (0.35) ALDH1A1KMT2AMEN1L3MBTL1PTGER4
SCHEMBL8022699 0.73 PTGS1 (0.34) ALDH1A1KMT2AMEN1TDP1L3MBTL1

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
EP-0975587-A1 OXIME ETHER COMPOUNDS, THEIR USE AND INTERMEDIATES FOR PREPARATIONS OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-02 EP disclosed
WO-1998043949-A1 OXIME ETHER COMPOUNDS, THEIR USE AND INTERMEDIATES FOR PREPARATIONS OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-10-08 WO disclosed