SCHEMBL7797389

SCHEMBL7797389

COc1cc(OC)cc(C(=O)OCC(F)(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.47
GAA P10253 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
PKM P14618 1/20 0.45
SERPINE1 P05121 1/20 0.44
JMJD6 Q6NYC1 1/20 0.43
ALDH1A1 P00352 3/20 0.42
TSHR P16473 2/20 0.42
NPC1 O15118 1/20 0.42
XBP1 P17861 1/20 0.42
RAB9A P51151 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NPSR1 Q6W5P4 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
SCHEMBL2612528 0.86 MAPK1 (0.52) GAAKDM4EMAPTSMN1; SMN2KMT2A
SCHEMBL2612559 0.84 SERPINE1 (0.49) GAAKDM4EMAPTSMN1; SMN2KMT2A
SCHEMBL17233760 0.83 CA1 (0.56) ELANEGAAMAPTSMN1; SMN2ALDH1A1
SCHEMBL2612550 0.81 SMN1; SMN2 (0.48) GAAKDM4EMAPTSMN1; SMN2KMT2A
SCHEMBL11236182 0.80 SERPINE1 (0.53) GAAKDM4EMAPTSMN1; SMN2KMT2A
SCHEMBL14092785 0.79 CA12 (0.49) GAAKDM4EMAPTSMN1; SMN2KMT2A
SCHEMBL3258075 0.78 MEN1 (0.64) MAPTSMN1; SMN2KMT2AMEN1PKM
SCHEMBL14812142 0.77 MEN1 (0.48) GAAKDM4EMAPTSMN1; SMN2KMT2A
SCHEMBL13755800 0.76 MAPK1 (0.42) GAAKDM4EMAPTSMN1; SMN2KMT2A
SCHEMBL13400124 0.76 SMN1; SMN2 (0.43) GAAKDM4EMAPTSMN1; SMN2KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1162885-A1 USE FOR CONIFER SAPLING PROTECTION Nordlander, Göran (SE) 2001-12-19 EP claimed
WO-2000056152-A1 USE FOR CONIFER SAPLING PROTECTION ROBIGUS AB (SE) 2000-09-28 WO claimed
EP-1162885-A1 USE FOR CONIFER SAPLING PROTECTION Nordlander, Göran (SE) 2001-12-19 EP disclosed
WO-2000056152-A1 USE FOR CONIFER SAPLING PROTECTION ROBIGUS AB (SE) 2000-09-28 WO disclosed