SCHEMBL2801209

SCHEMBL2801209

O=C(NO)c1ccc2[nH]c(=O)c(=O)n(O)c2c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 7/20 0.42
POLB P06746 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
B3GNT2 Q9NY97 3/20 0.40
DAO P14920 3/20 0.40
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC1 Q13547 3/20 0.38
HDAC8 Q9BY41 3/20 0.38

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
SCHEMBL2802039 0.84 B3GNT2 (0.52) KDM4EALDH1A1B3GNT2DAO
SCHEMBL9368648 0.78 DAO (0.44) ALDH1A1DAO
SCHEMBL9364597 0.74 DAO (0.70) KDM4EALDH1A1DAOMAPT
SCHEMBL8145145 0.74 DAO (0.70) KDM4EDAO
SCHEMBL9364598 0.74 DAO (0.70) DAO
SCHEMBL9364786 0.72 KDM4E (0.51) POLBKDM4EALDH1A1DAOMAPT
SCHEMBL9365531 0.71 FASN (0.44) DAO
SCHEMBL9365381 0.71 ALDH1A1 (0.48) POLBKDM4EALDH1A1DAOMAPT
SCHEMBL9368705 0.71 DAO (0.48) ALDH1A1DAOMAPT
SCHEMBL9080167 0.71 CA12 (0.52) HDAC6KDM4EALDH1A1DAOMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1005361-B1 USE OF FVIIa OR FVIIai FOR THE TREATMENT OF ENDOTHELIAL DYSFUNKTION AND FOR THE INHIBITION OF ANGIOGENESIS RESPECTIVELY NOVO NORDISK HEALTHCARE AG (CH) 2010-01-06 EP claimed
EP-1005361-A1 USE OF FVIIa OR FVIIai FOR THE TREATMENT OF ADVERSE CONDITIONS RELATED TO THE FVIIa MEDIATED INTRACELLULAR SIGNALLING PATHWAY NOVO NORDISK A/S (DK) 2000-06-07 EP claimed
WO-1999003498-A1 USE OF FVIIa OR FVIIai FOR THE TREATMENT OF ADVERSE CONDITIONS RELATED TO THE FVIIa MEDIATED INTRACELLULAR SIGNALLING PATHWAY NOVO NORDISK A/S (DK) 1999-01-28 WO claimed
US-5859010-A ANTICOAGULANTS NOVO NORDISK A/S (DK) 1999-01-12 US claimed
WO-1997049684-A1 FACTOR VII-BINDING REAGENT NOVO NORDISK A/S (DK) 1997-12-31 WO claimed
US-20150031747-A1 METHODS AND COMPOSITIONS FOR MODULATING FACTOR VII EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2015-01-29 US disclosed
EP-2812433-A1 METHODS AND COMPOSITIONS FOR MODULATING FACTOR VII EXPRESSION Isis Pharmaceuticals, Inc. (US) 2014-12-17 EP disclosed
WO-2013119979-A1 METHODS AND COMPOSITIONS FOR MODULATING FACTOR VII EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2013-08-15 WO disclosed
EP-1005361-B1 USE OF FVIIa OR FVIIai FOR THE TREATMENT OF ENDOTHELIAL DYSFUNKTION AND FOR THE INHIBITION OF ANGIOGENESIS RESPECTIVELY NOVO NORDISK HEALTHCARE AG (CH) 2010-01-06 EP disclosed
US-20070232542-A1 Methods for Modifying Cell Motility Using Factor VIIa Antagonist NOVO NORDISK A/S (DK) 2007-10-04 US disclosed
US-20070232542-A1 Methods for Modifying Cell Motility Using Factor VIIa Antagonist NOVO NORDISK A/S (DK) 2007-10-04 US disclosed
US-20050245449-A1 Methods for modifying cell motility using factor VIIa antagonist NOVO NORDISK, A/S (DK) 2005-11-03 US disclosed
US-20030040481-A1 Methods for modifying cell motility using a factor VIIa antagonist NOVO NORDISK HEALTHCARE A/G (CH) 2003-02-27 US disclosed
US-6461610-B1 Methods for modifying cell motility using factor VIIa or inactivated factor VIIa NOVO NORDISK A/S (DK) 2002-10-08 US disclosed
US-6268163-B1 DETECTION OF MODULATORS OF MEMBRANE PROTEIN ACTIVITY; CULTURE CELLS, MEASURE ACTIVATION OF MITOGEN ACTIVATED PROTEIN KINASE, COMPARE WITH CONTROL, ADJUSTMENT IN ACTIVATION INDICATES MODULATION OF SIGNAL TRANSDUCTION NOVO NORDISK A/S (DK) 2001-07-31 US disclosed
EP-1005361-A1 USE OF FVIIa OR FVIIai FOR THE TREATMENT OF ADVERSE CONDITIONS RELATED TO THE FVIIa MEDIATED INTRACELLULAR SIGNALLING PATHWAY NOVO NORDISK A/S (DK) 2000-06-07 EP disclosed
WO-1999003498-A1 USE OF FVIIa OR FVIIai FOR THE TREATMENT OF ADVERSE CONDITIONS RELATED TO THE FVIIa MEDIATED INTRACELLULAR SIGNALLING PATHWAY NOVO NORDISK A/S (DK) 1999-01-28 WO disclosed
US-5859010-A ANTICOAGULANTS NOVO NORDISK A/S (DK) 1999-01-12 US disclosed
WO-1997049684-A1 FACTOR VII-BINDING REAGENT NOVO NORDISK A/S (DK) 1997-12-31 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-20050245449-A1 Methods for modifying cell motility using factor VIIa antagonist TFPI, TFPI2, F13B HDAC6 1886/4885POLB 3200/4885KDM4E 3750/4885
US-20030040481-A1 Methods for modifying cell motility using a factor VIIa antagonist TFPI, TFPI2, F13B HDAC6 1610/4885POLB 3642/4885KDM4E 3599/4885
US-20070232542-A1 Methods for Modifying Cell Motility Using Factor VIIa Antagonist TFPI, TFPI2, F13B HDAC6 1886/4885POLB 3200/4885KDM4E 3750/4885

“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.