SCHEMBL9750825

SCHEMBL9750825

O=C(O)COc1ccc2ccc(O)cc2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 1/20 0.72
HCAR2 Q8TDS4 1/20 0.55
FFAR1 O14842 1/20 0.51
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
PPARG P37231 2/20 0.50
NCOA2 Q15596 2/20 0.50
NCOA1 Q15788 2/20 0.50
NCOA3 Q9Y6Q9 2/20 0.50
POLB P06746 1/20 0.50
KDM4E B2RXH2 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ATM Q13315 1/20 0.49
PPARD Q03181 1/20 0.49
ALOX15 P16050 2/20 0.49
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MCL1 Q07820 1/20 0.49
MIF P14174 1/20 0.48
HTT P42858 1/20 0.47

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
SCHEMBL9714119 0.96 PTPN7 (0.71) PTPN7HCAR2FFAR1KMT2AMEN1
SCHEMBL4076964 0.87 PTPN7 (0.85) PTPN7FFAR1KMT2AMEN1PPARG
SCHEMBL25640 0.84 PTPN7 (1.00) PTPN7FFAR1KMT2AMEN1PPARG
SCHEMBL29367022 0.84 PTPN7 (1.00) PTPN7FFAR1KMT2AMEN1PPARG
SCHEMBL9750796 0.83 L3MBTL1 (0.51) PTPN7HCAR2KMT2AMEN1KDM4E
SCHEMBL10344678 0.83 PTPN7 (0.72) PTPN7FFAR1KMT2AMEN1PPARG
SCHEMBL30439696 0.83 PTPN7 (0.72) PTPN7FFAR1KMT2AMEN1PPARG
SCHEMBL15201762 0.82 PTPN7 (0.96) PTPN7FFAR1KMT2AMEN1PPARG
SCHEMBL15201765 0.82 PTPN7 (0.96) PTPN7FFAR1KMT2AMEN1PPARG
SCHEMBL10902015 0.82 PTPN7 (0.89) PTPN7FFAR1KMT2AMEN1PPARG

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-5041609-A Plant growth regulators BAYER AKTIENGESELLSCHAFT (DE) 1991-08-20 US disclosed