SCHEMBL7547690

SCHEMBL7547690

Cn1c(OC(F)F)n[nH]c1=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
PDE3B Q13370 2/20 0.33
PDE3A Q14432 2/20 0.33
LMNA P02545 2/20 0.33
HPGD P15428 2/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP2C19 P33261 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL3211179 0.71 NOTUM (0.35) LMNAHPGDTSHRSMN1; SMN2POLB
SCHEMBL7552091 0.70 ADORA2A (0.32) MAPK1L3MBTL1
SCHEMBL7549227 0.69 ADRA1A (0.39) CYP1A2CYP2C9CYP2C19POLBL3MBTL1
SCHEMBL8801338 0.67 TDP1 (0.32) CYP1A2CYP2C9TDP1
SCHEMBL16324213 0.65 MAOA (0.43) PDE3BPDE3A
SCHEMBL762702 0.63
SCHEMBL21853447 0.63 TDP1 (0.41) LMNASMN1; SMN2TDP1KMT2A
SCHEMBL20108072 0.61 TDP1 (0.37) CYP1A2CYP2C9TDP1POLB
SCHEMBL3666602 0.61
SCHEMBL21853390 0.61

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-0813528-B1 HERBICIDAL OR FUNGICIDAL SULPHONYLAMINOCARBONYLTRIAZOLINONES WITH HALOGENATED ALK(EN)OXY SUBSTITUENTS BAYER AG (DE) 2002-06-19 EP disclosed
US-6121204-A SELECTIVE CONTROL OF MONOCOTYLEDONOUS AND DICOTYLEDONOUS WEEDS IN MONOCOTYLEDONOUS AND DICOTYLEDONOUS CROPS, BOTH PRE-EMERGENCE AND POST-EMERGENCE BAYER AKTIENGESELLSCHAFT (DE) 2000-09-19 US disclosed
EP-0813528-A1 HERBICIDAL OR FUNGICIDAL SULPHONYLAMINOCARBONYLTRIAZOLINONES WITH HALOGENATED ALK(EN)OXY SUBSTITUENTS BAYER AG (DE) 1997-12-29 EP disclosed
WO-1996027590-A1 HERBICIDAL OR FUNGICIDAL SULPHONYLAMINOCARBONYLTRIAZOLINONES WITH HALOGENATED ALK(EN)OXY SUBSTITUENTS BAYER AKTIENGESELLSCHAFT (DE) 1996-09-12 WO disclosed