SCHEMBL1714822

SCHEMBL1714822

O=C(NOCCCNS(=O)(=O)c1ccccc1)c1ccccc1NCc1ccncc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
NAMPT P43490 3/20 0.48
TDP1 Q9NUW8 1/20 0.47
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MAPK1 P28482 1/20 0.46
KDR P35968 5/20 0.45
FLT1 P17948 4/20 0.45
HTT P42858 1/20 0.44
KIT P10721 2/20 0.43
ABL1 P00519 1/20 0.43
EGFR P00533 1/20 0.43
CSF1R P07333 1/20 0.43
PDGFRB P09619 1/20 0.43
FLT4 P35916 1/20 0.43
BRAF P15056 1/20 0.41

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
SCHEMBL1714444 0.97 LMNA (0.48) LMNASMN1; SMN2NAMPTTDP1ALDH1A1
SCHEMBL1714691 0.90 NAMPT (0.47) LMNASMN1; SMN2NAMPTALDH1A1KDM4E
SCHEMBL1715569 0.88 KDR (0.45) NAMPTALDH1A1KDM4EGAAHPGD
SCHEMBL1715474 0.84 NAMPT (0.48) LMNASMN1; SMN2NAMPTALDH1A1KDR
SCHEMBL1715178 0.83 ALDH1A1 (0.50) LMNASMN1; SMN2NAMPTALDH1A1KDM4E
SCHEMBL1715054 0.82 KDR (0.48) SMN1; SMN2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1715227 0.82 KDR (0.50) ALDH1A1KDM4EHPGDHSD17B10MAPK1
SCHEMBL1714889 0.82 KDR (0.46) NAMPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1715135 0.82 ALDH1A1 (0.48) ALDH1A1KDM4EHPGDHSD17B10MAPK1
SCHEMBL1715543 0.82 KDR (0.46) SMN1; SMN2NAMPTALDH1A1KDM4EHPGD

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 13 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
CN-1906155-B Novel hydroxamic acid ester derivant and pharmaceutical use thereof LEO PHARMA AS 2010-06-23 CN 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
CN-1906155-B Novel hydroxamic acid ester derivant and pharmaceutical use thereof LEO PHARMA AS 2010-06-23 CN 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 LMNA 3439/4885SMN1; SMN2 4242/4885NAMPT 3192/4885

“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.