SCHEMBL6561189

SCHEMBL6561189

CNC(=O)C(=NOC)c1ccccc1CON=C(C)C(=NOC)[C@@H]1C[C@H]1c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.38
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
SIGMAR1 Q99720 2/20 0.34
KMT2A Q03164 2/20 0.34
PTGS2 P35354 1/20 0.34
MEN1 O00255 1/20 0.34
HDAC4 P56524 1/20 0.33
ALDH1A1 P00352 2/20 0.33

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
SCHEMBL6561771 1.00 HIF1A (0.38) HIF1AMAPK1SMN1; SMN2TDP1SIGMAR1
SCHEMBL6562543 0.93 HIF1A (0.41) HIF1APTGS2ALDH1A1
SCHEMBL6562547 0.93 HIF1A (0.41) HIF1APTGS2ALDH1A1
SCHEMBL6560523 0.91 HIF1A (0.48) HIF1AMAPK1SMN1; SMN2TDP1KMT2A
SCHEMBL6561763 0.89 MAPK1 (0.40) HIF1AMAPK1SMN1; SMN2TDP1KMT2A
SCHEMBL6561207 0.89 MAPK1 (0.40) HIF1AMAPK1SMN1; SMN2TDP1KMT2A
SCHEMBL6561205 0.89 MAPK1 (0.40) HIF1AMAPK1SMN1; SMN2TDP1KMT2A
SCHEMBL6225395 0.83 HIF1A (0.43) HIF1AALDH1A1
SCHEMBL6225394 0.83 HIF1A (0.43) HIF1AALDH1A1
SCHEMBL6560533 0.82 HIF1A (0.41) HIF1AMAPK1SMN1; SMN2TDP1PTGS2

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