SCHEMBL1714727

SCHEMBL1714727

COCCOc1cc(C#N)ccc1CONC(=O)c1ccccc1NCc1ccncc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.42
FLT1 P17948 5/20 0.42
KIT P10721 4/20 0.40
ABL1 P00519 2/20 0.40
CSF1R P07333 2/20 0.40
PDGFRB P09619 2/20 0.40
FLT4 P35916 2/20 0.40
EGFR P00533 1/20 0.40
ALDH1A1 P00352 1/20 0.39
BRAF P15056 2/20 0.39
POLB P06746 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
EPHB4 P54760 1/20 0.38
TSHR P16473 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
AURKA O14965 1/20 0.37
AURKB Q96GD4 1/20 0.37
ABCB1 P08183 1/20 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
SCHEMBL1715615 0.92 POLB (0.44) KDRFLT1KITABL1CSF1R
SCHEMBL1714870 0.87 TSHR (0.46) KDRFLT1KITABL1CSF1R
SCHEMBL1714430 0.85 KIT (0.43) KDRFLT1KITABL1CSF1R
SCHEMBL1715297 0.85 KDR (0.45) KDRFLT1KITABL1CSF1R
SCHEMBL1715142 0.85 KDR (0.43) KDRFLT1KITABL1CSF1R
SCHEMBL1715722 0.84 TSHR (0.41) KITALDH1A1BRAFRXFP1TSHR
SCHEMBL1715441 0.83 KDM4C (0.48) KDRFLT1POLBEPHB4
SCHEMBL1714589 0.83 KDR (0.43) KDRFLT1KITABL1CSF1R
SCHEMBL1714112 0.82 TSHR (0.41) CSF1RRXFP1TSHRAURKAAURKB
SCHEMBL1715115 0.82 KDR (0.47) KDRFLT1KITABL1CSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8034811-B2 Hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA A/S (DK) 2011-10-11 US claimed
EP-1697312-B1 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA AS (DK) 2011-07-20 EP claimed
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US claimed
JP-2007513098-A 2007-05-24 JP claimed
EP-1697312-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF Leo Pharma A/S (DK) 2006-09-06 EP claimed
WO-2005054179-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2005-06-16 WO claimed
US-8034811-B2 Hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA A/S (DK) 2011-10-11 US disclosed
EP-1697312-B1 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA AS (DK) 2011-07-20 EP disclosed
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US disclosed
EP-1697312-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF Leo Pharma A/S (DK) 2006-09-06 EP disclosed
WO-2005054179-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2005-06-16 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 (1 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-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof F9, F12, HDAC9 KDR 75/4885FLT1 19/4885KIT 406/4885

“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.