SCHEMBL4589321

SCHEMBL4589321

CCNC(=O)C(CNC(=O)c1ccccc1)c1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.52
LMNA P02545 2/20 0.52
GAA P10253 2/20 0.52
KMT2A Q03164 4/20 0.48
GLA P06280 2/20 0.47
HPGD P15428 1/20 0.47
MEN1 O00255 3/20 0.47
MRGPRX4 Q96LA9 2/20 0.47
MAPK1 P28482 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PKM P14618 1/20 0.46
TACR1 P25103 1/20 0.42
TRPM8 Q7Z2W7 2/20 0.42

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
SCHEMBL4589375 0.92 LMNA (0.53) POLBLMNAGAAKMT2AMEN1
SCHEMBL4588060 0.91 KMT2A (0.57) POLBLMNAGAAKMT2AGLA
SCHEMBL5177351 0.87 KMT2A (0.45) POLBLMNAGAAKMT2AMEN1
SCHEMBL4589611 0.86 KMT2A (0.49) POLBLMNAKMT2AHPGDMEN1
SCHEMBL5200663 0.85 KMT2A (0.53) POLBLMNAGAAKMT2AGLA
SCHEMBL6022882 0.80 KMT2A (0.54) POLBLMNAGAAKMT2AMEN1
SCHEMBL783552 0.77 LMNA (0.51) POLBLMNAGAAKMT2AGLA
SCHEMBL20333222 0.77 KMT2A (0.45) POLBLMNAGAAKMT2AGLA
SCHEMBL6553866 0.76 LMNA (0.60) POLBLMNAGAAKMT2AGLA
SCHEMBL20333225 0.75 MAPK1 (0.56) POLBLMNAGAAKMT2AHPGD

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1888535-A1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES Bayer CropScience S.A. (FR) 2008-02-20 EP disclosed
EP-1885698-A1 2-PYRIDINYLCYCLOALKYLBENZAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES Bayer CropScience S.A. (FR) 2008-02-13 EP disclosed
EP-1773777-A1 N-[2-(4-PYRIDINYL)ETHYL]BENZAMIDE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2007-04-18 EP disclosed
EP-1773812-A1 3-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AS FUNGICIDES Bayer CropScience S.A. (FR) 2007-04-18 EP disclosed
EP-1773776-A1 3-PYRIDINYLETHYLBENZAMIDE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2007-04-18 EP disclosed
EP-1771439-A1 4-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES USEFUL AS FUNGICIDES Bayer CropScience S.A. (FR) 2007-04-11 EP disclosed
WO-2006008194-A9 3-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2007-01-11 WO disclosed
EP-1740542-A1 2-PYRIDINYLCYCLOALKYLBENZAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2007-01-10 EP disclosed
WO-2006122952-A1 2-PYRIDINYLCYCLOALKYLBENZAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2006-11-23 WO disclosed
WO-2006117356-A1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2006-11-09 WO disclosed
EP-1694648-A1 2-PYRIDINYLETHYLBENZAMIDE DERIVATIVES Bayer CropScience S.A. (FR) 2006-08-30 EP disclosed
WO-2006008192-A1 N-[2-(4-PYRIDINYL)ETHYL]BENZAMIDE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2006-01-26 WO disclosed
WO-2006008194-A1 3-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2006-01-26 WO disclosed
WO-2006008193-A1 4-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES USEFUL AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2006-01-26 WO disclosed
WO-2006008191-A1 3-PYRIDINYLETHYLBENZAMIDE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2006-01-26 WO disclosed
WO-2005103004-A1 2-PYRIDINYLCYCLOALKYLBENZAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2005-11-03 WO disclosed
WO-2005058828-A1 2-PYRIDINYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE S.A. (FR) 2005-06-30 WO disclosed
WO-2005058833-A1 2-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2005-06-30 WO disclosed
EP-1531673-A2 NOVEL 2-PYRIDYLETHYLBENZAMIDE DERIVATIVE Bayer CropScience S.A. (FR) 2005-05-25 EP disclosed
WO-2004016088-A2 NOVEL 2-PYRIDYLETHYLBENZAMIDE DERIVATIVE BAYER CROPSCIENCE S.A. (FR) 2004-02-26 WO disclosed