SCHEMBL646459

SCHEMBL646459

FC(F)(F)[C](c1ccccc1)c1ccccc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
KCNK3 O14649 2/20 0.46
KCNK9 Q9NPC2 2/20 0.46
CES1 P23141 1/20 0.42
CNR2 P34972 2/20 0.40
CTNNB1 P35222 2/20 0.39
WNT3A P56704 2/20 0.39
POLB P06746 1/20 0.39
TAS2R14 Q9NYV8 2/20 0.37

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
SCHEMBL160202 0.79 LMNA (0.50) LMNAGAAKCNK3KCNK9CES1
SCHEMBL4630453 0.78 CES1 (0.56) LMNACES1POLB
SCHEMBL28567994 0.76 LMNA (0.47) LMNAGAAKCNK3KCNK9CES1
SCHEMBL31369140 0.76 GAA (0.56) LMNAGAAKCNK3KCNK9CES1
SCHEMBL3717986 0.76 GAA (0.56) LMNAGAAKCNK3KCNK9CES1
SCHEMBL27524184 0.74 LMNA (0.55) LMNAGAAKCNK3KCNK9CES1
SCHEMBL3244585 0.74 LMNA (0.53) LMNAGAAKCNK3KCNK9CNR2
SCHEMBL2493438 0.73 LMNA (0.57) LMNAGAAKCNK3KCNK9CNR2
SCHEMBL221518 0.72 LMNA (0.62) LMNAGAAKCNK3KCNK9CNR2
SCHEMBL31319408 0.72 LMNA (0.52) LMNAGAAKCNK3KCNK9CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4664597-B2 2011-04-06 JP claimed
EP-1511734-B1 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS INC (US) 2010-06-23 EP claimed
US-20090005580-A1 Compounds, compositions and methods CYTOKINETICS, INC. 2009-01-01 US claimed
EP-1511734-A4 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS INC (US) 2006-05-10 EP claimed
US-20060020008-A1 Treating cell proliferation disorder, anticancer agents CYTOKINETICS, INC. 2006-01-26 US claimed
JP-2005523312-A 2005-08-04 JP claimed
US-6924376-B2 Compounds, compositions and methods CYTOKINETICS, INC. (US) 2005-08-02 US claimed
EP-1511734-A2 COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2005-03-09 EP claimed
US-20040082638-A1 Compounds, compositions and methods CYTOKINETICS, INC. 2004-04-29 US claimed
WO-2003088903-A2 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2003-10-30 WO claimed
US-8633236-B2 Compounds, compositions and methods CYTOKINETICS, INC. (US) 2014-01-21 US disclosed
US-20130053436-A1 COMPOUNDS, COMPOSITIONS AND METHODS MCDONALD ANDREW (US) 2013-02-28 US disclosed
US-8329928-B2 Compounds, compositions and methods CYTOKINETICS, INCORPORATED (US) 2012-12-11 US disclosed
US-20120209012-A1 COMPOUNDS, COMPOSITIONS AND METHODS MCDONALD ANDREW (US) 2012-08-16 US disclosed
US-8119678-B2 Compounds, compositions and methods CYTOKINETICS, INCORPORATED (US) 2012-02-21 US disclosed
EP-1554265-A2 COMPOUNDS, COMPOSITIONS AND METHODS Cytokinetics, Inc. (US) 2005-07-20 EP disclosed
EP-1511734-A2 COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2005-03-09 EP disclosed
US-20040082638-A1 Compounds, compositions and methods CYTOKINETICS, INC. 2004-04-29 US disclosed
WO-2004024086-A2 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2004-03-25 WO disclosed
WO-2003088903-A2 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2003-10-30 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-20060020008-A1 Treating cell proliferation disorder, anticancer agents MKI67, PCNA, TK1 LMNA 2572/4885GAA 292/4885KCNK3 3154/4885
US-20040082638-A1 Compounds, compositions and methods ALPP, PCNA, MKI67 LMNA 568/4885GAA 367/4885KCNK3 2721/4885
US-20090005580-A1 Compounds, compositions and methods ALPP, PCNA, MKI67 LMNA 568/4885GAA 367/4885KCNK3 2721/4885
US-20120209012-A1 COMPOUNDS, COMPOSITIONS AND METHODS ALPP, PCNA, MKI67 LMNA 568/4885GAA 367/4885KCNK3 2721/4885
US-20130053436-A1 COMPOUNDS, COMPOSITIONS AND METHODS ALPP, PCNA, MKI67 LMNA 568/4885GAA 367/4885KCNK3 2721/4885

“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.