SCHEMBL8532199

SCHEMBL8532199

CCOc1ccc(C2(/C=C(\F)C(=O)OC)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
TET3 O43151 1/20 0.41
FBXL19 Q6PCT2 1/20 0.41
CXXC5 Q7LFL8 1/20 0.41
TET1 Q8NFU7 1/20 0.41
KDM2B Q8NHM5 1/20 0.41
CXXC4 Q9H2H0 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
LMNA P02545 2/20 0.39
CYP1A2 P05177 2/20 0.39
PLK1 P53350 1/20 0.39
POLB P06746 1/20 0.39
MEN1 O00255 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 3/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
PARP10 Q53GL7 1/20 0.38
MAPT P10636 3/20 0.37

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
SCHEMBL8532204 1.00 KMT2A (0.41) KMT2ATET3FBXL19CXXC5TET1
SCHEMBL8529941 0.82 HSD11B1 (0.35) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL8529945 0.82 HSD11B1 (0.35) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL8532211 0.82 SLC6A4 (0.43) KMT2ASLC6A2SLC6A4SLC6A3PIM1
SCHEMBL8532213 0.82 SLC6A4 (0.43) KMT2ASLC6A2SLC6A4SLC6A3PIM1
SCHEMBL8530705 0.82 PDE2A (0.41) KMT2ALMNAPOLBMEN1ALDH1A1
SCHEMBL8530709 0.82 PDE2A (0.41) KMT2ALMNAPOLBMEN1ALDH1A1
SCHEMBL8531175 0.81 ALDH1A1 (0.39) ALDH1A1KDM4ESMN1; SMN2
SCHEMBL8531171 0.81 ALDH1A1 (0.39) ALDH1A1KDM4ESMN1; SMN2
SCHEMBL8531549 0.78 NQO1 (0.41) KMT2ATET3FBXL19CXXC5TET1

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
US-5763700-A INSECTICIDES BRITISH TECHNOLOGY GROUP LIMITED (GB) 1998-06-09 US disclosed
EP-0660815-B1 PESTICIDAL FLUOROOLEFINS BRITISH TECH GROUP (GB) 1997-04-16 EP disclosed
WO-1994006741-A1 PESTICIDAL FLUOROOLEFINS BRITISH TECHNOLOGY GROUP LIMITED (GB) 1994-03-31 WO disclosed