SCHEMBL2139197

SCHEMBL2139197

FC(F)Oc1ccc(N2CCNC(c3ccccc3)C2)cc1OCC1CC1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 15/20 0.45
PDE4B Q07343 7/20 0.45
PDE4A P27815 4/20 0.44
PDE4C Q08493 4/20 0.44
PDE10A Q9Y233 1/20 0.42
PDE1C Q14123 1/20 0.39
PDE5A O76074 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
SCHEMBL873607 1.00 PDE4D (0.45) PDE4DPDE4BPDE4APDE4CPDE10A
SCHEMBL2136570 0.85 PDE4D (0.48) PDE4DPDE4BPDE4APDE4CPDE10A
SCHEMBL683205 0.85 PDE4D (0.48) PDE4DPDE4BPDE4APDE4CPDE10A
SCHEMBL2140730 0.85 PDE4B (0.40) PDE4DPDE4BPDE4APDE4CPDE10A
SCHEMBL873454 0.85 PDE4D (0.42) PDE4DPDE4BPDE4APDE4CPDE10A
SCHEMBL873456 0.85 PDE4B (0.40) PDE4DPDE4BPDE4APDE4CPDE10A
SCHEMBL2138522 0.85 PDE4D (0.42) PDE4DPDE4BPDE4APDE4CPDE10A
Hydrochloric Acid SCHEMBL873645 0.85 PDE4D (0.47) PDE4DPDE4BPDE4APDE4CPDE10A
Hydrochloric Acid SCHEMBL2138519 0.85 PDE4D (0.47) PDE4DPDE4BPDE4APDE4CPDE10A
SCHEMBL874599 0.81 PRKCA (0.47) PDE4DPDE4BPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110065691-A1 THERAPEUTIC PIPERAZINES DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2011-03-17 US claimed
US-8927546-B2 Therapeutic piperazines DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2015-01-06 US disclosed
US-20110065691-A1 THERAPEUTIC PIPERAZINES DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2011-03-17 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-20110065691-A1 THERAPEUTIC PIPERAZINES PDE4A, PDE4B, PDE4D PDE4D 3/4885PDE4B 2/4885PDE4A 1/4885

“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.