SCHEMBL3216560

SCHEMBL3216560

O=C(N[C@H]1CC[C@H](NC(=O)c2cc(F)cnc2Oc2cccc(-c3ccc(CCCO)cc3)c2)CC1)c1cc2n(n1)CCCC2.[Pd].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.57
CYP3A4 P08684 2/20 0.52
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KCNH2 Q12809 1/20 0.46

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
SCHEMBL3211094 0.94 PDE4B (0.63) PDE4BCYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL3211091 0.94 PDE4B (0.63) PDE4BCYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL3204905 0.91 PDE4B (0.60) PDE4BCYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL7961701 0.91 PDE4B (0.60) PDE4BCYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL3204902 0.91 PDE4B (0.60) PDE4BCYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL3203527 0.91 PDE4B (0.64) PDE4BCYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL3203533 0.91 PDE4B (0.64) PDE4BCYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL3213125 0.87 PDE4B (0.63) PDE4BCYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL3213130 0.87 PDE4B (0.63) PDE4BCYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL18258690 0.87 PDE4B (0.63) PDE4BCYP3A4CYP2C9CYP2C19KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2778156-B1 Phenoxypyridinylamide derivatives and their use in the treatment of PDE4 mediated disease states ASTRAZENECA AB (SE) 2016-11-30 EP disclosed
EP-2778156-A1 Phenoxypyridinylamide derivatives and their use in the treatment of PDE4 mediated disease states AstraZeneca AB (Publ) (SE) 2014-09-17 EP disclosed
US-8273774-B2 Phenoxypyridinylamide compounds ASTRAZENECA AB (SE) 2012-09-25 US disclosed
US-20100041638-A1 Chemical Compounds 293 ASTRAZENECA AB (SE) 2010-02-18 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-20100041638-A1 Chemical Compounds 293 PDE4B, PDE4A, PDE3B PDE4B 1/4885CYP3A4 92/4885CYP2C9 175/4885

“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.