SCHEMBL6652870

SCHEMBL6652870

CNC(=O)C(=NOC)c1ccccc1CON=C(C)/C(=N\OC)OC(C)C

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.41
PTGS2 P35354 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.30
GAA P10253 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL5079839 1.00 HIF1A (0.41) HIF1APTGS2SMN1; SMN2GAAALDH1A1
SCHEMBL6652621 0.91 HIF1A (0.39) HIF1APTGS2
SCHEMBL6652334 0.88 HIF1A (0.39) HIF1APTGS2ALDH1A1
SCHEMBL6652330 0.88 HIF1A (0.39) HIF1APTGS2ALDH1A1
SCHEMBL13148667 0.87 HIF1A (0.46) HIF1APTGS2ALDH1A1LMNA
SCHEMBL3163678 0.84 HIF1A (0.44) HIF1APTGS2ALDH1A1LMNA
SCHEMBL12704666 0.84 HIF1A (0.44) HIF1APTGS2ALDH1A1LMNA
SCHEMBL12963018 0.84 HIF1A (0.44) HIF1APTGS2ALDH1A1LMNA
SCHEMBL14175285 0.84 HIF1A (0.44) HIF1APTGS2ALDH1A1LMNA
SCHEMBL5972018 0.84 HIF1A (0.44) HIF1APTGS2ALDH1A1LMNA

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-1083790-B1 RETARDING FORMULATIONS OF ACTIVE SUBSTANCES USED FOR PLANT PROTECTION BASF AG (DE) 2004-04-28 EP disclosed
EP-1102533-B1 SOIL GRANULATES WITH CONTROLLED ACTIVE INGREDIENT RELEASE (CR SOIL GRANULATES) BASF AG (DE) 2003-11-26 EP disclosed
US-6541425-B1 Sustained release; fungicide, herbicide, insecticide BASF AKTIENGESELLSCHAFT (DE) 2003-04-01 US disclosed