SCHEMBL4518372

SCHEMBL4518372

NNS(=O)(=O)c1ccccn1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
GLO1 Q04760 6/20 0.50
SLC40A1 Q9NP59 3/20 0.50
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
KAT6A Q92794 1/20 0.45
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
LOX P28300 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MMP2 P08253 1/20 0.41
NLRP3 Q96P20 1/20 0.41
ALDH1A1 P00352 1/20 0.41
METAP2 P50579 1/20 0.40
NFE2L2 Q16236 1/20 0.40

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
SCHEMBL17489126 0.83 L3MBTL1 (0.59) L3MBTL1GLO1SLC40A1KDM4EPKM
SCHEMBL22313300 0.81 L3MBTL1 (0.58) L3MBTL1GLO1SLC40A1KDM4EPKM
SCHEMBL2371864 0.79 L3MBTL1 (0.56) L3MBTL1GLO1SLC40A1KDM4EPKM
SCHEMBL762825 0.79 L3MBTL1 (0.56) L3MBTL1GLO1SLC40A1KDM4EPKM
SCHEMBL29706147 0.79 L3MBTL1 (0.56) L3MBTL1GLO1SLC40A1KDM4EPKM
SCHEMBL10734794 0.79 L3MBTL1 (0.56) L3MBTL1GLO1SLC40A1KDM4EPKM
SCHEMBL11060698 0.79 L3MBTL1 (0.56) L3MBTL1GLO1SLC40A1KDM4EPKM
SCHEMBL12000989 0.79 L3MBTL1 (0.56) L3MBTL1GLO1SLC40A1KDM4EPKM
SCHEMBL17372076 0.79 L3MBTL1 (0.65) L3MBTL1GLO1SLC40A1KDM4EPKM
SCHEMBL3371308 0.78 L3MBTL1 (0.59) L3MBTL1GLO1SLC40A1KAT6AMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090054413-A1 Novel 5,6-Dihydropyrazolo[3,4-E] [L,4]Diazepin-4 (IH) -One Derivatives for the Treatment of Asthma and Chronic Obstructive Pulmonary Disease ASTRAZENECA AB (SE) 2009-02-26 US disclosed
EP-1931672-A1 NOVEL 5,6-DIHYDROPYRAZOLO[3,4-E] [L,4]DIAZEPIN-4 (IH) -ONE DERIVATIVES FOR THE TREATMENT OF ASTHMA AND CHRONIC OBSTRUCTIVE PULMONARY DISEASE. AstraZeneca AB (SE) 2008-06-18 EP disclosed
WO-2007040435-A1 NOVEL 5,6-DIHYDROPYRAZOLO[3,4-E] [L,4]DIAZEPIN-4 (IH) -ONE DERIVATIVES FOR THE TREATMENT OF ASTHMA AND CHRONIC OBSTRUCTIVE PULMONARY DISEASE. ASTRAZENECA AB (SE) 2007-04-12 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-20090054413-A1 Novel 5,6-Dihydropyrazolo[3,4-E] [L,4]Diazepin-4 (IH) -One Derivatives for the Treatment of Asthma and Chronic Obstructive Pulmonary Disease PDE4B, PDE4A, PDE12 L3MBTL1 4535/4885GLO1 1726/4885SLC40A1 4701/4885

“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.