SCHEMBL402649

SCHEMBL402649

Cc1ccc(NC(=O)Nc2cc(F)cc(CN3CCN(C)CC3)c2)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 2/20 0.49
PAK4 O96013 1/20 0.49
NTRK1 P04629 1/20 0.49
TBK1 Q9UHD2 1/20 0.49
BRAF P15056 2/20 0.47
KDR P35968 2/20 0.47
CSF1R P07333 1/20 0.44
FLT3 P36888 1/20 0.44
MAPK14 Q16539 1/20 0.44
KIT P10721 2/20 0.44
ABL1 P00519 1/20 0.44
BCR P11274 1/20 0.44
EPHX2 P34913 1/20 0.43
HTR1A P08908 2/20 0.43
HTR1D P28221 2/20 0.43
HTR1B P28222 2/20 0.43
EGFR P00533 1/20 0.42
ALK Q9UM73 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 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
SCHEMBL402839 0.91 WNT1 (0.48) MAPTMAPK8MAPK10WNT1CLK2
SCHEMBL398292 0.90 MAP4K4 (0.45) PLK4PAK4NTRK1TBK1MAPK8
SCHEMBL3209186 0.90 FAAH (0.44) PLK4PAK4NTRK1TBK1HTR1A
SCHEMBL14465815 0.89 PLK4 (0.40) PLK4PAK4NTRK1TBK1BRAF
SCHEMBL401660 0.89 NPC1 (0.49) PLK4PAK4NTRK1TBK1EPHX2
SCHEMBL402023 0.88 KDM4E (0.43) PLK4PAK4NTRK1TBK1HTR1A
SCHEMBL399020 0.88 PIK3CA (0.50) PLK4PAK4NTRK1TBK1WNT1
SCHEMBL400684 0.88 PIK3CA (0.44) PLK4PAK4NTRK1TBK1BRAF
SCHEMBL18827056 0.88 PIK3CA (0.44) PLK4PAK4NTRK1TBK1HTR1A
SCHEMBL398722 0.87 MAP4K4 (0.47) PLK4PAK4NTRK1TBK1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210198203-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2021-07-01 US claimed
US-20190352267-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2019-11-21 US claimed
US-20180305316-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2018-10-25 US claimed
EP-2862859-A2 Compounds, compositions and methods Cytokinetics, Inc. (US) 2015-04-22 EP claimed
US-20150005296-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2015-01-01 US claimed
US-20090036447-A1 Compounds, Compositions and Methods CYTOKINETICS, INC. (US) 2009-02-05 US claimed
US-20060014761-A1 Substituted urea derivatives activate the cardiac sarcomere by potentiating cardiac myosin; systolic heart failure including congestive heart failure; 4-[(3-fluoro-5-{[(6-methyl(3-pyridyl))amino]carbonylamino}-phenyl)methyl]piperazinecarboxylate CYTOKINETICS, INCORPORATED 2006-01-19 US claimed
US-12264133-B2 Compounds, compositions and methods CYTOKINETICS, INCORPORATED (US) 2025-04-01 US disclosed
US-20220185779-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2022-06-16 US disclosed
US-20210198203-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2021-07-01 US disclosed
US-10975034-B2 Compounds, compositions and methods CYTOKINETICS, INC. (US) 2021-04-13 US disclosed
US-20190352267-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2019-11-21 US disclosed
US-10385023-B2 Compounds, compositions and methods CYTOKINETICS, INC. (US) 2019-08-20 US disclosed
US-20090036447-A1 Compounds, Compositions and Methods CYTOKINETICS, INC. (US) 2009-02-05 US disclosed
US-20070208000-A1 Certain chemical entities, compositions and methods CYTOKINETICS, INC. 2007-09-06 US disclosed
US-20070197505-A1 Certain chemical entities, compositions and methods CYTOKINETICS, INC. 2007-08-23 US disclosed
US-20070161617-A1 Certain chemical entities, compositions and methods CYTOKINETICS, INC. 2007-07-12 US disclosed
EP-1765327-A2 COMPOUNDS, COMPOSITIONS AND METHODS Cytokinetics, Inc. (US) 2007-03-28 EP disclosed
WO-2006009726-A2 SUBSTITUTED UREA DERIVATIVES FOR TREATING CARDIAC DISEASES CYTOKINETICS, INC. (US) 2006-01-26 WO disclosed
US-20060014761-A1 Substituted urea derivatives activate the cardiac sarcomere by potentiating cardiac myosin; systolic heart failure including congestive heart failure; 4-[(3-fluoro-5-{[(6-methyl(3-pyridyl))amino]carbonylamino}-phenyl)methyl]piperazinecarboxylate CYTOKINETICS, INCORPORATED 2006-01-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070161617-A1 Certain chemical entities, compositions and methods TNNI3, TNNT2, MYLK2 PLK4 1554/4885PAK4 1493/4885NTRK1 4867/4885
US-20060014761-A1 Substituted urea derivatives activate the cardiac sarcomere by potentiating cardiac myosin; systolic heart failure including congestive heart failure; 4-[(3-fluoro-5-{[(6-methyl(3-pyridyl))amino]carbonylamino}-phenyl)methyl]piperazinecarboxylate TNNI3, MYLK2, TNNT2 PLK4 725/4885PAK4 332/4885NTRK1 4835/4885
US-10385023-B2 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 PLK4 1476/4885PAK4 1433/4885NTRK1 4881/4885
US-20220185779-A1 COMPOUNDS, COMPOSITIONS AND METHODS TNNI3, TNNC1, TNNT2 PLK4 1476/4885PAK4 1433/4885NTRK1 4881/4885
US-12264133-B2 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 PLK4 1476/4885PAK4 1433/4885NTRK1 4881/4885
US-20190352267-A1 COMPOUNDS, COMPOSITIONS AND METHODS TNNI3, TNNC1, TNNT2 PLK4 1476/4885PAK4 1433/4885NTRK1 4881/4885
US-20070208000-A1 Certain chemical entities, compositions and methods TNNI3, TNNT2, MYLK2 PLK4 1554/4885PAK4 1493/4885NTRK1 4867/4885
US-20070197505-A1 Certain chemical entities, compositions and methods TNNC1, TNNI3, TNNT2 PLK4 2831/4885PAK4 1512/4885NTRK1 3689/4885
US-20150005296-A1 COMPOUNDS, COMPOSITIONS AND METHODS TNNI3, TNNC1, TNNT2 PLK4 1476/4885PAK4 1433/4885NTRK1 4881/4885
US-10975034-B2 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 PLK4 1476/4885PAK4 1433/4885NTRK1 4881/4885
US-20090036447-A1 Compounds, Compositions and Methods TNNI3, TNNC1, TNNT2 PLK4 1476/4885PAK4 1433/4885NTRK1 4881/4885
US-20180305316-A1 COMPOUNDS, COMPOSITIONS AND METHODS TNNI3, TNNC1, TNNT2 PLK4 1476/4885PAK4 1433/4885NTRK1 4881/4885
US-20210198203-A1 COMPOUNDS, COMPOSITIONS AND METHODS TNNI3, TNNC1, TNNT2 PLK4 1476/4885PAK4 1433/4885NTRK1 4881/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.