SCHEMBL6848284

SCHEMBL6848284

CCOC(=O)C(CCCC(F)(F)Cl)C(=O)OCC

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
L3MBTL1 Q9Y468 6/20 0.40
MAPK1 P28482 4/20 0.40
TSHR P16473 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
POLB P06746 2/20 0.36
PTPN1 P18031 1/20 0.35
CPB2 Q96IY4 1/20 0.33
THRB P10828 1/20 0.33
PKM P14618 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 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
SCHEMBL5356481 0.81 TDP1 (0.45) TDP1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL8157644 0.80 TDP1 (0.42) TDP1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL7659602 0.80 TDP1 (0.56) TDP1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL11655565 0.80 TDP1 (0.56) TDP1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL18291061 0.79 TDP1 (0.43) TDP1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL15183509 0.79 TDP1 (0.49) TDP1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL6901399 0.78 TDP1 (0.55) TDP1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL21073906 0.78 TDP1 (0.55) TDP1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL2224230 0.76 TDP1 (0.54) TDP1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL1562155 0.76 TDP1 (0.50) TDP1KMT2AMEN1L3MBTL1MAPK1

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-0661289-B1 Vinyl carboxamide derivatives as insecticides and acaricides SYNGENTA PARTICIPATIONS AG (CH) 2004-03-03 EP disclosed
US-5763481-A PESTICIDES; INSECTICIDES, MITICIDES NOVARTIS CORPROATION (US) 1998-06-09 US disclosed
US-5545630-A PESTICIDES CIBA-GEIGY CORPORATION (US) 1996-08-13 US disclosed
EP-0661289-A1 Vinyl carboxamide derivatives as insecticides and acaricides CIBA-GEIGY AG (CH) 1995-07-05 EP disclosed