SCHEMBL1759131

SCHEMBL1759131

COc1ccccc1C(CO)c1cccc(-c2ccccc2)c1OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.47
GAA P10253 2/20 0.47
SI P14410 2/20 0.47
MGAM2 Q2M2H8 2/20 0.47
KDM4E B2RXH2 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
BCHE P06276 6/20 0.45
RXRA P19793 2/20 0.45
RXRB P28702 1/20 0.45
RXRG P48443 1/20 0.45
PTGER1 P34995 2/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
FFAR1 O14842 1/20 0.42
SCN9A Q15858 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42

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
SCHEMBL1638059 0.87 MGAM (0.47) MGAMGAASIMGAM2KDM4E
SCHEMBL1758876 0.85 BCHE (0.46) MGAMGAASIMGAM2KDM4E
SCHEMBL12725985 0.83 BCHE (0.57) MGAMGAASIMGAM2KDM4E
SCHEMBL1759130 0.82 L3MBTL1 (0.47) MGAMGAASIMGAM2KDM4E
SCHEMBL1643988 0.82 MGAM (0.46) MGAMGAASIMGAM2KDM4E
SCHEMBL1759387 0.81 FFAR1 (0.47) MGAMGAASIMGAM2KDM4E
SCHEMBL1641884 0.80 SGMS2 (0.53) MGAMGAASIMGAM2KDM4E
SCHEMBL1637949 0.80 MAPK1 (0.46) MGAMGAASIMGAM2L3MBTL1
SCHEMBL1638577 0.79 HTR7 (0.45) MGAMGAASIMGAM2BCHE
SCHEMBL12727689 0.78 SGMS2 (0.48) MGAMGAASIMGAM2KDM4E

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-2493933-A2 CATALYST COMPOUNDS AND USE THEREOF ExxonMobil Chemical Patents Inc. (US) 2012-09-05 EP disclosed
WO-2011056424-A2 CATALYST COMPOUNDS AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-05-12 WO disclosed