SCHEMBL6561763

SCHEMBL6561763

CON=C(C(N)=O)c1ccccc1CO/N=C(\C)C(=NOC)[C@@H]1C[C@H]1c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SLC9A1 P19634 2/20 0.37
HIF1A Q16665 6/20 0.37
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TRPM5 Q9NZQ8 2/20 0.33
PTGS2 P35354 1/20 0.33
HDAC4 P56524 1/20 0.32

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
SCHEMBL6561205 1.00 MAPK1 (0.40) MAPK1SMN1; SMN2TDP1SLC9A1HIF1A
SCHEMBL6561207 1.00 MAPK1 (0.40) MAPK1SMN1; SMN2TDP1SLC9A1HIF1A
SCHEMBL6560533 0.93 HIF1A (0.41) MAPK1SMN1; SMN2TDP1SLC9A1HIF1A
SCHEMBL6560537 0.93 HIF1A (0.41) MAPK1SMN1; SMN2TDP1SLC9A1HIF1A
SCHEMBL6560523 0.90 HIF1A (0.48) MAPK1SMN1; SMN2TDP1HIF1AALDH1A1
SCHEMBL6227065 0.89 MAPK1 (0.42) MAPK1SMN1; SMN2TDP1SLC9A1HIF1A
SCHEMBL6227068 0.89 MAPK1 (0.42) MAPK1SMN1; SMN2TDP1SLC9A1HIF1A
SCHEMBL6227062 0.89 MAPK1 (0.42) MAPK1SMN1; SMN2TDP1SLC9A1HIF1A
SCHEMBL6561189 0.89 HIF1A (0.38) MAPK1SMN1; SMN2TDP1HIF1AALDH1A1
SCHEMBL6561771 0.89 HIF1A (0.38) MAPK1SMN1; SMN2TDP1HIF1AALDH1A1

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-1120403-B1 Aryl and heteroarylcyclopropyl oxime ethers and their use as fungicides and insecticides DOW AGROSCIENCES LLC (US) 2004-03-17 EP 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