SCHEMBL1567751

SCHEMBL1567751

O=[N+]([O-])c1ccc(F)cc1Sc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 8/20 0.56
▸ PDE7B Q9NP56 2/20 0.55
▸ TDP1 Q9NUW8 2/20 0.51
▸ ATM Q13315 1/20 0.51
▸ GSTP1 P09211 1/20 0.51
▸ GSTM2 P28161 1/20 0.51
▸ ABCC9 O60706 1/20 0.51
▸ ABCC8 Q09428 1/20 0.51
▸ KCNJ11 Q14654 1/20 0.51
▸ KCNJ8 Q15842 1/20 0.51
▸ MAPT P10636 4/20 0.50
▸ IDO1 P14902 1/20 0.49
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ HTT P42858 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ POLB P06746 1/20 0.47

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
SCHEMBL6743647 0.87 PDE7A (0.73) PDE7APDE7BTDP1ATMGSTP1
SCHEMBL28405 0.81 PDE7A (0.77) PDE7APDE7BTDP1GSTP1GSTM2
SCHEMBL2614719 0.80 PDE7A (0.59) PDE7APDE7BGSTP1GSTM2MAPT
SCHEMBL30338244 0.79 PDE7A (0.65) PDE7APDE7BTDP1GSTP1GSTM2
SCHEMBL1713219 0.79 PDE7A (0.65) PDE7APDE7BTDP1GSTP1GSTM2
SCHEMBL18376634 0.78 POLB (0.57) PDE7AGSTP1GSTM2ABCC9ABCC8
SCHEMBL27225074 0.77 GSTP1 (0.54) TDP1ATMGSTP1GSTM2MAPT
SCHEMBL6741226 0.76 PDE7A (0.67) PDE7APDE7BTDP1ATMMAPT
SCHEMBL29662268 0.76 ATM (0.58) PDE7ATDP1ATMMAPTIDO1
SCHEMBL1151368 0.76 ATM (0.58) PDE7ATDP1ATMMAPTIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8653257-B2 Dibenzothiazepine derivatives and uses thereof—424 ASTRAZENECA AB (SE) 2014-02-18 — — US claimed
US-20120202991-A1 DIBENZOTHIAZEPINE DERIVATIVES AND USES THEREOF - 424 ASTRAZENECA AB (SE) 2012-08-09 — — US claimed
US-8653257-B2 Dibenzothiazepine derivatives and uses thereof—424 ASTRAZENECA AB (SE) 2014-02-18 — — US disclosed
EP-2307389-B1 DIBENZOTHIAZEPINE DERIVATIVE AND USE THEREOF ASTRAZENECA AB (SE) 2013-01-23 — — EP disclosed
US-20120202991-A1 DIBENZOTHIAZEPINE DERIVATIVES AND USES THEREOF - 424 ASTRAZENECA AB (SE) 2012-08-09 — — US disclosed
US-8158618-B2 Dibenzothiazepine derivatives and uses thereof—424 ASTRAZENECA AB (SE) 2012-04-17 — — US disclosed
US-20110160184-A1 Dibenzothiazepine Derivatives and Use Thereof ASTRAZENECA AB (SE) 2011-06-30 — — US disclosed
EP-2307389-A1 DIBENZOTHIAZEPINE DERIVATIVES AND USE THEREOF AstraZeneca AB (SE) 2011-04-13 — — EP disclosed
US-20090318415-A1 DIBENZOTHIAZEPINE DERIVATIVES AND USES THEREOF - 424 ASTRAZENECA AB (SE) 2009-12-24 — — US disclosed
WO-2009154563-A1 DIBENZOTHIAZEPINE DERIVATIVES AND USE THEREOF ASTRAZENECA AB (SE) 2009-12-23 — — 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-20090318415-A1 DIBENZOTHIAZEPINE DERIVATIVES AND USES THEREOF - 424 DRD4, DRD2, GABBR1 PDE7A 1159/4885PDE7B 720/4885TDP1 2534/4885
US-20110160184-A1 Dibenzothiazepine Derivatives and Use Thereof DRD2, DRD4, GABBR1 PDE7A 1140/4885PDE7B 706/4885TDP1 2086/4885
US-20120202991-A1 DIBENZOTHIAZEPINE DERIVATIVES AND USES THEREOF - 424 DRD4, DRD2, GABBR1 PDE7A 1159/4885PDE7B 720/4885TDP1 2534/4885

“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.

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