SCHEMBL4179699

SCHEMBL4179699

CC(C)(C)OC(=O)N[C@H](C=O)CCCNC(=O)OCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.62
CTSK P43235 10/20 0.57
CTSL P07711 2/20 0.53
CTSB P07858 2/20 0.53
KLK7 P49862 2/20 0.53
KLK5 Q9Y337 2/20 0.53
SYK P43405 1/20 0.53
HTT P42858 1/20 0.51
TGM2 P21980 1/20 0.49
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
CTSH P09668 1/20 0.48
FOLH1 Q04609 1/20 0.47

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
SCHEMBL4821212 0.97 MAPT (0.66) MAPTCTSKCTSLCTSBKLK7
SCHEMBL5500108 0.96 SYK (0.58) MAPTCTSKCTSLCTSBKLK7
SCHEMBL12247705 0.93 MAPT (0.61) MAPTCTSKCTSLCTSBKLK7
SCHEMBL699601 0.93 MAPT (0.61) MAPTCTSKCTSLCTSBKLK7
SCHEMBL29458828 0.86 SYK (0.63) MAPTCTSKCTSLCTSBSYK
SCHEMBL24152311 0.86 FOLH1 (0.58) CTSKHTTTGM2FOLH1
SCHEMBL8607096 0.86 FOLH1 (0.58) CTSKHTTTGM2FOLH1
SCHEMBL13430791 0.85 SYK (0.48) MAPTCTSKCTSLCTSBKLK7
SCHEMBL13480482 0.85 MAPT (0.65) MAPTKLK7KLK5SYKHTT
SCHEMBL16279355 0.85 MAPT (0.60) MAPTCTSKKLK7KLK5SYK

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7528137-B2 Compounds, compositions, and methods CYTOKINETICS, INC. (US) 2009-05-05 US disclosed
EP-1539727-B1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING CELLULAR PROLIFERATIVE DISEASES CYTOKINETICS INC (US) 2009-02-18 EP disclosed
US-7214800-B2 Compounds, compositions, and methods CYTOKINETICS, INC. (US) 2007-05-08 US disclosed
EP-1539727-A4 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS INC (US) 2007-04-04 EP disclosed
EP-1556357-A4 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS INC (US) 2006-09-13 EP disclosed
EP-1553931-A4 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS INC (US) 2006-08-30 EP disclosed
US-7041676-B2 Compounds, compositions, and methods CYTOKINETICS, INC. (US) 2006-05-09 US disclosed
US-20060094735-A1 Compounds, compositions, and methods CYTOKINETICS, INC. 2006-05-04 US disclosed
US-20060019988-A1 Compounds for treating cell prolifieration disease with of kinesin activity , anticancer activity CYTOKINETICS, INC. 2006-01-26 US disclosed
US-20060004073-A1 Compounds, compositions, and methods CYTOKINETICS, INC. 2006-01-05 US disclosed
US-6949538-B2 Compounds, compositions, and methods CYTOKINETICS, INC. (US) 2005-09-27 US disclosed
EP-1556357-A1 COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2005-07-27 EP disclosed
EP-1553931-A1 COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2005-07-20 EP disclosed
EP-1539727-A2 COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2005-06-15 EP disclosed
US-20040116400-A1 Compounds, compositions, and methods CYTOKINETICS, INC. 2004-06-17 US disclosed
US-20040082567-A1 Compounds, compositions, and methods CYTOKINETICS, INC. 2004-04-29 US disclosed
US-20040077668-A1 Compounds, compositins, and methods CYTOKINETICS, INC. 2004-04-22 US disclosed
WO-2004006865-A2 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2004-01-22 WO disclosed
WO-2003106426-A1 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2003-12-24 WO disclosed
WO-2003097053-A1 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2003-11-27 WO 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 (5 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-20040077668-A1 Compounds, compositins, and methods CEP170, PSAP, PACSIN2 MAPT 1449/4885CTSK 1191/4885CTSL 1556/4885
US-20060094735-A1 Compounds, compositions, and methods ALPP, PCNA, MKI67 MAPT 2954/4885CTSK 1172/4885CTSL 2514/4885
US-20060019988-A1 Compounds for treating cell prolifieration disease with of kinesin activity , anticancer activity KIF5B, KIF2C, KIF18A MAPT 964/4885CTSK 287/4885CTSL 1117/4885
US-20060004073-A1 Compounds, compositions, and methods ALPP, PCNA, MKI67 MAPT 2954/4885CTSK 1172/4885CTSL 2514/4885
US-20040082567-A1 Compounds, compositions, and methods ALPP, PCNA, MKI67 MAPT 2954/4885CTSK 1172/4885CTSL 2514/4885

“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.