SCHEMBL1714376

SCHEMBL1714376

O=C(O)c1ccccc1NCc1ccc2oc(=O)ccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 5/20 0.57
HPGD P15428 3/20 0.54
ALDH1A1 P00352 2/20 0.54
HSD17B10 Q99714 2/20 0.54
POLB P06746 1/20 0.54
CTDSP1 Q9GZU7 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MAOB P27338 1/20 0.54
CA12 O43570 5/20 0.51
CA9 Q16790 5/20 0.51
CA2 P00918 4/20 0.51
CA3 P07451 4/20 0.51
CA4 P22748 4/20 0.51
CA7 P43166 4/20 0.51
CA14 Q9ULX7 4/20 0.51
CA5B Q9Y2D0 4/20 0.51
CA6 P23280 3/20 0.51
CA5A P35218 3/20 0.51
KDM4E B2RXH2 1/20 0.49
ACHE P22303 1/20 0.49

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
SCHEMBL12461711 0.86 DRD4 (0.50) DRD4HPGDALDH1A1MAOBCA12
SCHEMBL1715801 0.82 ALDH1A1 (0.57) HPGDALDH1A1HSD17B10POLBCTDSP1
SCHEMBL7524521 0.82 ALDH1A1 (0.66) HPGDALDH1A1HSD17B10POLBCTDSP1
SCHEMBL12461818 0.80 DRD4 (0.44) DRD4HPGDALDH1A1POLBMAOB
SCHEMBL1715282 0.77 PGR (0.43) DRD4HPGDALDH1A1MAOBCA12
SCHEMBL5583222 0.77 TP53 (0.51) HPGDALDH1A1HSD17B10POLBCTDSP1
SCHEMBL2691864 0.73 HSD17B10 (0.81) HPGDALDH1A1HSD17B10POLBCTDSP1
SCHEMBL8180363 0.72 DRD4 (1.00) DRD4ALDH1A1MAOBCA12CA9
SCHEMBL4927828 0.71 CA12 (0.68) DRD4ALDH1A1CA12CA9CA2
SCHEMBL11498895 0.71 ALDH1A1 (0.77) HPGDALDH1A1HSD17B10POLBCTDSP1

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-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US claimed
CN-1906155-A Novel hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA AS (DK) 2007-01-31 CN claimed
US-8034811-B2 Hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA A/S (DK) 2011-10-11 US disclosed
US-8034811-B2 Hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA A/S (DK) 2011-10-11 US disclosed
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
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US disclosed
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US disclosed
CN-1906155-A Novel hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA AS (DK) 2007-01-31 CN 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 DRD4 2228/4885HPGD 301/4885ALDH1A1 804/4885

“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.