SCHEMBL14935906

SCHEMBL14935906

O=C(Cc1c(Cl)cncc1Cl)c1ccc(OC(F)F)c2c1OC1(CCOCC1)O2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 11/20 1.00
PDE4D Q08499 10/20 0.61
PDE4B Q07343 1/20 0.61
PDE3B Q13370 1/20 0.61
PDE3A Q14432 1/20 0.61

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
SCHEMBL17772020 0.93 PDE4A (0.86) PDE4APDE4DPDE4BPDE3BPDE3A
SCHEMBL7700632 0.93 PDE4A (0.86) PDE4APDE4DPDE4BPDE3BPDE3A
SCHEMBL30869220 0.90 PDE4A (0.81) PDE4APDE4DPDE4BPDE3BPDE3A
SCHEMBL7702419 0.90 PDE4A (0.81) PDE4APDE4DPDE4BPDE3BPDE3A
SCHEMBL14947100 0.89 PDE4A (1.00) PDE4APDE4DPDE4BPDE3BPDE3A
SCHEMBL3304195 0.87 PDE4A (0.77) PDE4APDE4DPDE4BPDE3BPDE3A
SCHEMBL14936339 0.87 PDE4A (1.00) PDE4APDE4DPDE4BPDE3BPDE3A
SCHEMBL1697754 0.85 PDE4A (1.00) PDE4APDE4DPDE4BPDE3BPDE3A
SCHEMBL1697755 0.83 PDE4A (0.81) PDE4APDE4DPDE4BPDE3BPDE3A
SCHEMBL7698433 0.83 PDE4A (0.70) PDE4APDE4DPDE4BPDE3BPDE3A

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3070091-A1 BENZODIOXOLE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2016-09-21 EP claimed
US-20130123291-A1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2013-05-16 US claimed
EP-3070091-B1 BENZODIOXOLE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA AS (DK) 2019-04-17 EP disclosed
EP-3070091-B1 BENZODIOXOLE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA AS (DK) 2019-04-17 EP disclosed
US-9637499-B2 Benzodioxole or benzodioxepine heterocyclic compounds as phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2017-05-02 US disclosed
US-9637499-B2 Benzodioxole or benzodioxepine heterocyclic compounds as phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2017-05-02 US disclosed
US-9637499-B2 Benzodioxole or benzodioxepine heterocyclic compounds as phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2017-05-02 US disclosed
EP-3070091-A1 BENZODIOXOLE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2016-09-21 EP disclosed
EP-2585469-B1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA AS (DK) 2016-05-25 EP disclosed
US-9273064-B2 Benzodioxole or benzodioxepine heterocyclic compounds as phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2016-03-01 US disclosed
US-9273064-B2 Benzodioxole or benzodioxepine heterocyclic compounds as phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2016-03-01 US disclosed
US-20150111915-A1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2015-04-23 US disclosed
US-20150111915-A1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2015-04-23 US disclosed
US-20150111915-A1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2015-04-23 US disclosed
US-8980905-B2 Benzodioxole or benzodioxepine heterocyclic compounds as phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2015-03-17 US disclosed
US-8980905-B2 Benzodioxole or benzodioxepine heterocyclic compounds as phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2015-03-17 US disclosed
US-8980905-B2 Benzodioxole or benzodioxepine heterocyclic compounds as phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2015-03-17 US disclosed
US-20130123291-A1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2013-05-16 US disclosed
US-20130123291-A1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2013-05-16 US disclosed
US-20130123291-A1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2013-05-16 US 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 (2 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-20150111915-A1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS PDE3A, PDE4A, PDE2A PDE4A 2/4885PDE4D 16/4885PDE4B 6/4885
US-20130123291-A1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS PDE3A, PDE4A, PDE2A PDE4A 2/4885PDE4D 18/4885PDE4B 6/4885

“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.