SCHEMBL9714119

SCHEMBL9714119

O=C(O)COc1ccc2cc(O)ccc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 1/20 0.71
HCAR2 Q8TDS4 1/20 0.57
FFAR1 O14842 1/20 0.54
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
KDM4E B2RXH2 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
ALOX15 P16050 2/20 0.52
TSHR P16473 1/20 0.51
HSD17B10 Q99714 1/20 0.51
MCL1 Q07820 1/20 0.51
PPARD Q03181 1/20 0.51
MIF P14174 1/20 0.50
LMNA P02545 1/20 0.50
CA2 P00918 1/20 0.49
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
POLB P06746 1/20 0.49
PPARG P37231 1/20 0.49
NCOA2 Q15596 1/20 0.49

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
SCHEMBL9750825 0.96 PTPN7 (0.72) PTPN7HCAR2FFAR1KMT2AMEN1
SCHEMBL4076964 0.90 PTPN7 (0.85) PTPN7FFAR1KMT2AMEN1KDM4E
SCHEMBL29367022 0.83 PTPN7 (1.00) PTPN7FFAR1KMT2AMEN1KDM4E
SCHEMBL25640 0.83 PTPN7 (1.00) PTPN7FFAR1KMT2AMEN1KDM4E
SCHEMBL9714152 0.82 L3MBTL1 (0.54) PTPN7HCAR2FFAR1KDM4ETSHR
SCHEMBL274850 0.82 ALOX15 (0.68) PTPN7FFAR1KMT2AMEN1ALOX15
SCHEMBL15201765 0.81 PTPN7 (0.96) PTPN7FFAR1KMT2AMEN1KDM4E
SCHEMBL15201762 0.81 PTPN7 (0.96) PTPN7FFAR1KMT2AMEN1KDM4E
SCHEMBL10299391 0.81 PTPN7 (0.71) PTPN7FFAR1KMT2AMEN1KDM4E
SCHEMBL10902015 0.81 PTPN7 (0.89) PTPN7FFAR1KMT2AMEN1KDM4E

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
US-5079384-A Weed killers, destroy broad leaf plants, postemergence BAYER AKTIENGESELLSCHAFT (DE) 1992-01-07 US disclosed