SCHEMBL6561782

SCHEMBL6561782

CO/C=C(/C(=O)O)c1ccccc1CON=C(C)C(=NO)[C@@H]1C[C@H]1c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PTGS2 P35354 1/20 0.34
RAB9A P51151 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
TRPM5 Q9NZQ8 2/20 0.32
SLC9A1 P19634 1/20 0.32
MAPT P10636 1/20 0.31
HDAC4 P56524 1/20 0.31
HRH3 Q9Y5N1 2/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL6561780 1.00 MAPK1 (0.37) MAPK1SMN1; SMN2TDP1PTGS2RAB9A
SCHEMBL6561354 0.93 MAPK1 (0.37) MAPK1SMN1; SMN2TDP1PTGS2KMT2A
SCHEMBL6561351 0.93 MAPK1 (0.37) MAPK1SMN1; SMN2TDP1PTGS2KMT2A
SCHEMBL6561882 0.89 MAPK1 (0.35) MAPK1SMN1; SMN2TDP1PTGS2KMT2A
SCHEMBL6561217 0.89 MAPK1 (0.35) MAPK1SMN1; SMN2TDP1PTGS2KMT2A
SCHEMBL6561222 0.89 MAPK1 (0.35) MAPK1SMN1; SMN2TDP1PTGS2KMT2A
SCHEMBL6561885 0.89 MAPK1 (0.35) MAPK1SMN1; SMN2TDP1PTGS2KMT2A
SCHEMBL6561459 0.84 MAPK1 (0.34) MAPK1SMN1; SMN2TDP1KMT2AMEN1
SCHEMBL6561462 0.84 MAPK1 (0.34) MAPK1SMN1; SMN2TDP1KMT2AMEN1
SCHEMBL6224820 0.76 SLC9A1 (0.38) PTGS2KMT2AMEN1TRPM5SLC9A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1120403-B1 Aryl and heteroarylcyclopropyl oxime ethers and their use as fungicides and insecticides DOW AGROSCIENCES LLC (US) 2004-03-17 EP disclosed
US-6313339-B1 Aryl and heteroarylcylopropyl oxime ethers and their use as fungicides and insecticides ROHM AND HAAS ASIA, INC. 2001-11-06 US disclosed
EP-1120403-A2 Aryl and heteroarylcyclopropyl oxime ethers and their use as fungicides and insecticides ROHM AND HAAS COMPANY (US) 2001-08-01 EP disclosed