SCHEMBL10352467

SCHEMBL10352467

CCOC(=O)c1c(C(F)(F)F)nc(OC)c(C(OC)OCC)c1OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.36
POLB P06746 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 4/20 0.33
HPGD P15428 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RORC P51449 1/20 0.32
IDO1 P14902 1/20 0.32
GAA P10253 2/20 0.32
CYP3A4 P08684 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.30
PKM P14618 1/20 0.30
HTT P42858 1/20 0.30
PDE4D Q08499 1/20 0.30
CDC7 O00311 1/20 0.30
DBF4 Q9UBU7 1/20 0.30
SLC10A2 Q12908 1/20 0.30

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
SCHEMBL10672952 0.82 KDM4E (0.36) KDM4EPOLBMAPTKMT2AALDH1A1
SCHEMBL10352473 0.81 KDM4E (0.43) KDM4EPOLBMAPTKMT2AALDH1A1
SCHEMBL10370698 0.79 KDM4E (0.47) KDM4EPOLBMAPTKMT2AALDH1A1
SCHEMBL10351682 0.78 KDM4E (0.40) KDM4EPOLBMAPTKMT2AALDH1A1
SCHEMBL9726331 0.78 KDM4E (0.37) KDM4EPOLBMAPTKMT2AALDH1A1
SCHEMBL10352470 0.78 KDM4E (0.35) KDM4EPOLBMAPTKMT2AALDH1A1
SCHEMBL10351676 0.77 KDM4E (0.42) KDM4EPOLBMAPTKMT2AALDH1A1
SCHEMBL10351858 0.76 KDM4E (0.39) KDM4EPOLBMAPTKMT2AALDH1A1
SCHEMBL10351879 0.75 GAA (0.41) KDM4EPOLBMAPTKMT2AALDH1A1
SCHEMBL10352389 0.75 KDM4E (0.41) KDM4EPOLBMAPTKMT2AALDH1A1

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-0181311-B1 SUBSTITUTED 4,6-ALKOXY PYRIDINECARBOXYLATE COMPOUNDS Monsanto Company (US) 1990-08-29 EP disclosed
US-4741766-A Substituted 4,6-alkoxy pyridinecarboxylate compounds and herbicidal use MONSANTO COMPANY (US) 1988-05-03 US disclosed
US-4609399-A PRE- AND POSTEMERGENCE MONSANTO COMPANY (US) 1986-09-02 US disclosed
EP-0181311-A2 Substituted 4,6-alkoxy pyridinecarboxylate compounds Monsanto Company (US) 1986-05-14 EP disclosed