SCHEMBL211710

SCHEMBL211710

CN(C(=O)NCc1cccc(F)c1Cl)C(CCCN)COC(=O)Nc1cc2cc(F)ccc2cn1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 10/20 0.33
CTSK P43235 1/20 0.32
CARM1 Q86X55 2/20 0.31
MAPK1 P28482 1/20 0.31
RPS6KA1 Q15418 1/20 0.31
P2RX7 Q99572 1/20 0.30
PRMT6 Q96LA8 1/20 0.30
PIK3C3 Q8NEB9 1/20 0.30

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
SCHEMBL211709 1.00 ABL1 (0.33) ABL1CTSKCARM1MAPK1RPS6KA1
SCHEMBL211446 1.00 ABL1 (0.33) ABL1CTSKCARM1MAPK1RPS6KA1
SCHEMBL2723174 0.96 ABL1 (0.34) ABL1CTSKCARM1MAPK1RPS6KA1
SCHEMBL214138 0.94 ABL1 (0.33) ABL1CTSKMAPK1RPS6KA1P2RX7
SCHEMBL2723275 0.94 ABL1 (0.32) ABL1CTSKMAPK1RPS6KA1
SCHEMBL213943 0.94 ABL1 (0.34) ABL1CTSKMAPK1RPS6KA1
SCHEMBL212587 0.94 ABL1 (0.33) ABL1CTSKMAPK1RPS6KA1P2RX7
SCHEMBL2724406 0.93 ABL1 (0.34) ABL1CARM1MAPK1RPS6KA1P2RX7
SCHEMBL210608 0.93 CTSK (0.37) ABL1CTSKMAPK1P2RX7
SCHEMBL211715 0.93 CARM1 (0.35) ABL1CARM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895582-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2014-11-25 US disclosed
US-8759374-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2014-06-24 US disclosed
US-20130053348-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS QIAN XIANGPING (US) 2013-02-28 US disclosed
US-20120135964-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS QIAN XIANGPING (US) 2012-05-31 US disclosed
US-8088793-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2012-01-03 US disclosed
EP-2195328-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Incorporated (US) 2010-06-16 EP disclosed
US-20090275537-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2009-11-05 US disclosed
WO-2009023193-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INCORPORATED (US) 2009-02-19 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 (3 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-20090275537-A1 Certain chemical entities, compositions, and methods MYLK, MYH2, MYH10 ABL1 956/4885CTSK 1455/4885CARM1 1403/4885
US-20120135964-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS MYLK, MYH2, MYH10 ABL1 956/4885CTSK 1455/4885CARM1 1403/4885
US-20130053348-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS MYLK, MYH2, MYH10 ABL1 956/4885CTSK 1455/4885CARM1 1403/4885

“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.