SCHEMBL8380211

SCHEMBL8380211

COc1cc(OC)nc(Oc2cccnc2C(=O)OCc2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
TSHR P16473 1/20 0.44
CASP3 P42574 1/20 0.44
RAB9A P51151 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
POLB P06746 2/20 0.44
EGLN1 Q9GZT9 1/20 0.42
CTSA P10619 2/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
ADORA1 P30542 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL732099 0.88 CTSA (0.54) L3MBTL1TSHRCASP3RAB9ASENP8
SCHEMBL27404065 0.82 KDM4E (0.46) L3MBTL1TSHRCTSAKDM4EALDH1A1
SCHEMBL9693873 0.79 NPSR1 (0.53) L3MBTL1CTSAALDH1A1
SCHEMBL9197691 0.79 KMT2A (0.47) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL9693378 0.77 CTSA (0.52) CTSAALDH1A1
SCHEMBL9692112 0.77 CTSA (0.49) L3MBTL1CTSAKDM4EALDH1A1MAPT
SCHEMBL2835796 0.77 POLB (0.57) L3MBTL1TSHRCASP3RAB9ASENP8
SCHEMBL8882254 0.76 KDM4E (0.53) KDM4EALDH1A1MAPTMAOAMAOB
SCHEMBL9376865 0.75 EDNRA (0.43) L3MBTL1TSHRRAB9APOLBKDM4E
SCHEMBL9693462 0.74 CTSA (0.57) L3MBTL1CASP3SENP8SENP7SENP6

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
EP-0569944-B1 Synergistic herbicide combination HOECHST SCHERING AGREVO GMBH (DE) 1999-03-31 EP claimed