SCHEMBL1010015

SCHEMBL1010015

COc1ccc(N(Cc2cccc(C#N)c2)Cc2c(Cl)cncc2Cl)cc1OC

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 5/20 0.45
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
MRGPRX4 Q96LA9 2/20 0.40
PDE4D Q08499 1/20 0.39
SLC16A3 O15427 1/20 0.38
SLC16A1 P53985 1/20 0.38
PDE5A O76074 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
CYP19A1 P11511 2/20 0.37
SRC P12931 1/20 0.37
PDK1 Q15118 1/20 0.36
P2RX7 Q99572 1/20 0.36
QPCT Q16769 1/20 0.36

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
SCHEMBL1010002 0.86 QPCT (0.49) CCR5PDE4DQPCT
SCHEMBL1009113 0.85 PDE4D (0.45) PDE4DSLC16A3SLC16A1QPCT
SCHEMBL1008443 0.85 PDE4D (0.47) PDE4D
SCHEMBL1010197 0.84 PDE4D (0.44) PDE4DQPCT
SCHEMBL1008929 0.81 PDE4D (0.44) PDE4DQPCT
SCHEMBL1008748 0.80 PDE4D (0.45) PDE4DP2RX7QPCT
SCHEMBL1008845 0.79 PDE4D (0.44) PDE4DQPCT
SCHEMBL1009473 0.79 PDE4D (0.42) PDE4DPDK1
SCHEMBL1010050 0.79 NR3C1 (0.50) PDE4DQPCT
SCHEMBL1011391 0.78 L3MBTL1 (0.44) PDE4D

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
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
US-7820698-B2 Phosphodiesterase-4 inhibitors belonging to the tertiary amine class CHIESI FARMACEUTICI S.P.A. (IT) 2010-10-26 US 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 CCR5 3350/4885FNTA 2162/4885FNTB 2247/4885

“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.