SCHEMBL3160402

SCHEMBL3160402

COc1ccc(C2(C#N)CCN(C(=O)OC(C)(C)C)CC2)cc1OC1CCCC1

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.70
PDE4A P27815 18/20 0.70
PDE4C Q08493 18/20 0.70
PDE4D Q08499 18/20 0.70

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
SCHEMBL3177853 0.85 PDE4A (0.81) PDE4BPDE4APDE4CPDE4D
SCHEMBL3166221 0.82 PDE4A (1.00) PDE4BPDE4APDE4CPDE4D
SCHEMBL3166256 0.82 PDE4A (0.82) PDE4BPDE4APDE4CPDE4D
Bicarbonate SCHEMBL3981807 0.82 PDE4A (0.74) PDE4BPDE4APDE4CPDE4D
Hydrochloric Acid SCHEMBL3166076 0.81 PDE4A (0.98) PDE4BPDE4APDE4CPDE4D
SCHEMBL7321654 0.81 PDE4A (0.82) PDE4BPDE4APDE4CPDE4D
SCHEMBL3174850 0.81 PDE4A (1.00) PDE4BPDE4APDE4CPDE4D
Bicarbonate SCHEMBL4603657 0.81 PDE4A (0.80) PDE4BPDE4APDE4CPDE4D
SCHEMBL7449841 0.80 PDE4B (0.64) PDE4BPDE4APDE4CPDE4D
SCHEMBL30683833 0.80 PDE4A (0.80) PDE4BPDE4APDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7649095-B2 Piperidine derivatives and agent comprising the derivative as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-01-19 US disclosed
US-7649095-B2 Piperidine derivatives and agent comprising the derivative as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-01-19 US disclosed
EP-1308440-B1 PIPERIDINE DERIVATIVES AND DRUGS CONTAINING THESE DERIVATIVES AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2009-05-06 EP disclosed
EP-1308440-B1 PIPERIDINE DERIVATIVES AND DRUGS CONTAINING THESE DERIVATIVES AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2009-05-06 EP disclosed
US-7109342-B2 Piperidine derivatives and agent comprising the derivative as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-09-19 US disclosed
US-20060189656-A1 Piperidine derivatives and agent comprising the derivative as active ingredient ONO PHARMACEUTICAL CO., LTD. 2006-08-24 US disclosed
US-20040044036-A1 Piperidine derivatives and drugs containing these derivatives as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2004-03-04 US disclosed
EP-1308440-A1 PIPERIDINE DERIVATIVES AND DRUGS CONTAINING THESE DERIVATIVES AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2003-05-07 EP 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-20040044036-A1 Piperidine derivatives and drugs containing these derivatives as active ingredient PDE4A, PDE4B, PDE4D PDE4B 2/4885PDE4A 1/4885PDE4C 4/4885
US-20060189656-A1 Piperidine derivatives and agent comprising the derivative as active ingredient PDE4A, PDE4B, PDE4D PDE4B 2/4885PDE4A 1/4885PDE4C 4/4885

“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.