SCHEMBL1065950

SCHEMBL1065950

COc1ccc(N(Cc2ccc(S(N)(=O)=O)cc2)Cc2c(Cl)cncc2Cl)cc1OC

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.45
CA2 P00918 4/20 0.45
CA9 Q16790 4/20 0.45
CA12 O43570 1/20 0.43
CA4 P22748 1/20 0.43
PDE4D Q08499 3/20 0.42
PTGS2 P35354 7/20 0.41
PTGS1 P23219 5/20 0.41
CA7 P43166 1/20 0.41
CA14 Q9ULX7 1/20 0.41
TSHR P16473 1/20 0.41
PDE4A P27815 2/20 0.40
PDE4B Q07343 2/20 0.40
PDE4C Q08493 2/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
NLRP3 Q96P20 1/20 0.39

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
SCHEMBL3450744 0.92 CA1 (0.46) CA1CA2CA9CA12CA4
SCHEMBL1009086 0.91 PDE4D (0.43) PDE4DPTGS2PTGS1PDE4APDE4B
SCHEMBL1008748 0.86 PDE4D (0.45) CA1CA2CA9CA12PDE4D
SCHEMBL1008443 0.85 PDE4D (0.47) CA2PDE4DTSHRALDH1A1KDM4E
SCHEMBL1008845 0.85 PDE4D (0.44) PDE4DPDE4BALDH1A1KDM4EHPGD
SCHEMBL1009113 0.83 PDE4D (0.45) PDE4DPDE4APDE4BPDE4C
SCHEMBL1011460 0.82 PDE4D (0.54) CA1CA2CA9CA12CA4
SCHEMBL1008929 0.81 PDE4D (0.44) PDE4DALDH1A1KDM4E
SCHEMBL1011438 0.81 PDE4D (0.53) PDE4DPDE4APDE4BPDE4CALDH1A1
SCHEMBL1010017 0.79 QPCT (0.40) PDE4DPDE4APDE4BPDE4CALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2268632-B1 TERTIARY AMINE DERIVATIVES AS PHOSPHODIESTERASE-4 INHIBITORS CHIESI FARMA SPA (IT) 2012-08-08 EP claimed
EP-2268632-A1 TERTIARY AMINE DERIVATIVES AS PHOSPHODIESTERASE-4 INHIBITORS CHIESI FARMACEUTICI S.p.A. (IT) 2011-01-05 EP claimed
WO-2009127320-A1 TERTIARY AMINE DERIVATIVES AS PHOSPHODIESTERASE-4 INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2009-10-22 WO claimed
EP-2110375-A1 Phosphodiesterase-4 inhibitors belonging to the tertiary amine class CHIESI FARMACEUTICI S.p.A. (IT) 2009-10-21 EP claimed
US-20090258905-A1 PHOSPHODIESTERASE-4 INHIBITORS BELONGING TO THE TERTIARY AMINE CLASS CHIESI FARMACEUTICI S.P.A. (IT) 2009-10-15 US claimed
EP-2268632-B1 TERTIARY AMINE DERIVATIVES AS PHOSPHODIESTERASE-4 INHIBITORS CHIESI FARMA SPA (IT) 2012-08-08 EP disclosed
US-7820698-B2 Phosphodiesterase-4 inhibitors belonging to the tertiary amine class CHIESI FARMACEUTICI S.P.A. (IT) 2010-10-26 US disclosed
EP-2110375-A1 Phosphodiesterase-4 inhibitors belonging to the tertiary amine class CHIESI FARMACEUTICI S.p.A. (IT) 2009-10-21 EP disclosed
US-20090258905-A1 PHOSPHODIESTERASE-4 INHIBITORS BELONGING TO THE TERTIARY AMINE CLASS CHIESI FARMACEUTICI S.P.A. (IT) 2009-10-15 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 (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-20090258905-A1 PHOSPHODIESTERASE-4 INHIBITORS BELONGING TO THE TERTIARY AMINE CLASS PDE4A, PDE4B, PDE2A CA1 3252/4885CA2 1417/4885CA9 1217/4885

“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.