SCHEMBL1715765

SCHEMBL1715765

NOCc1ccccc1NC(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.56
HDAC1 Q13547 2/20 0.56
HDAC2 Q92769 2/20 0.56
MAPK1 P28482 1/20 0.56
KCNK3 O14649 1/20 0.54
KCNK9 Q9NPC2 1/20 0.54
MDM4 O15151 1/20 0.51
TP53 P04637 1/20 0.51
POLB P06746 1/20 0.51
HPGD P15428 1/20 0.51
NR1H4 Q96RI1 1/20 0.50
BACE1 P56817 1/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MAPT P10636 2/20 0.48

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
SCHEMBL3816268 0.86 NPC1 (0.61) HDAC3HDAC1HDAC2MAPK1KCNK3
SCHEMBL27647896 0.85 IDO1 (0.48) POLBHPGDMAPT
SCHEMBL7511265 0.81 HDAC3 (0.61) HDAC3HDAC1HDAC2MAPK1KCNK3
SCHEMBL1715806 0.80 ALDH1A1 (0.51) MAPK1POLBHPGDNPC1RAB9A
SCHEMBL528445 0.80 KCNK3 (0.77) HDAC3HDAC1HDAC2MAPK1KCNK3
Carbamic Acid SCHEMBL7517546 0.79 HDAC3 (0.57) HDAC3HDAC1HDAC2MAPK1KCNK3
SCHEMBL21711305 0.78 NR1H4 (0.75) HDAC3HDAC1HDAC2MAPK1KCNK3
SCHEMBL8902669 0.78 KCNK3 (0.57) HDAC3HDAC1HDAC2MAPK1KCNK3
SCHEMBL6971074 0.78 NR1H4 (0.57) HDAC3HDAC1HDAC2MAPK1KCNK3
SCHEMBL8654405 0.78 KCNK3 (0.57) HDAC3HDAC1HDAC2MAPK1KCNK3

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-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
CN-1906155-A Novel hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA AS (DK) 2007-01-31 CN 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
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 HDAC3 68/4885HDAC1 45/4885HDAC2 219/4885

“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.