SCHEMBL4588060

SCHEMBL4588060

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

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.57
LMNA P02545 2/20 0.53
POLB P06746 2/20 0.53
GAA P10253 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.49
GLA P06280 2/20 0.48
HPGD P15428 1/20 0.48
MEN1 O00255 2/20 0.48
MAPK1 P28482 1/20 0.47
TRPM8 Q7Z2W7 2/20 0.47
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
RECQL P46063 1/20 0.45
USP2 O75604 1/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TACR1 P25103 1/20 0.43
MRGPRX4 Q96LA9 2/20 0.43

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
SCHEMBL5200663 0.94 KMT2A (0.53) KMT2ALMNAPOLBGAASMN1; SMN2
SCHEMBL4589321 0.91 POLB (0.52) KMT2ALMNAPOLBGAASMN1; SMN2
SCHEMBL6022882 0.89 KMT2A (0.54) KMT2ALMNAPOLBGAASMN1; SMN2
SCHEMBL4589375 0.83 LMNA (0.53) KMT2ALMNAPOLBGAASMN1; SMN2
SCHEMBL4589611 0.78 KMT2A (0.49) KMT2ALMNAPOLBSMN1; SMN2HPGD
SCHEMBL5177351 0.78 KMT2A (0.45) KMT2ALMNAPOLBGAASMN1; SMN2
SCHEMBL20333222 0.78 KMT2A (0.45) KMT2ALMNAPOLBGAASMN1; SMN2
SCHEMBL6553866 0.77 LMNA (0.60) KMT2ALMNAPOLBGAASMN1; SMN2
SCHEMBL20333225 0.76 MAPK1 (0.56) KMT2ALMNAPOLBGAASMN1; SMN2
SCHEMBL784578 0.76 LMNA (0.53) KMT2ALMNAPOLBGAAGLA

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 25 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
EP-1720865-A1 2-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES Bayer CropScience S.A. (FR) 2006-11-15 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-2005103004-A1 2-PYRIDINYLCYCLOALKYLBENZAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2005-11-03 WO disclosed
WO-2005085238-A1 2-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2005-09-15 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-2005014545-A2 N-′2-(2-PYRIDINYL) ETHYLBENZAMIDE COMPOUNDS AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE S.A. (FR) 2005-02-17 WO disclosed
WO-2004016088-A2 NOVEL 2-PYRIDYLETHYLBENZAMIDE DERIVATIVE BAYER CROPSCIENCE S.A. (FR) 2004-02-26 WO disclosed