SCHEMBL4356954

SCHEMBL4356954

CN(C)c1ccc(C(=O)Cc2c(Cl)cncc2Cl)c2cc(C3CC3)nn12

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.52
PDE4D Q08499 11/20 0.43
PDE4A P27815 4/20 0.43
PDE4C Q08493 2/20 0.43
CRACR2A Q9BSW2 1/20 0.35

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
SCHEMBL4277927 0.85 PDE4B (0.72) PDE4BPDE4DPDE4APDE4C
SCHEMBL4121765 0.84 PDE4B (0.55) PDE4BPDE4DPDE4APDE4CCRACR2A
SCHEMBL4125686 0.83 PDE4B (0.72) PDE4BPDE4D
SCHEMBL4370511 0.74 PDE4B (0.67) PDE4BPDE4DPDE4APDE4C
SCHEMBL4133353 0.73 PDE4B (0.64) PDE4B
SCHEMBL14684520 0.72 PDE4B (0.50) PDE4BPDE4DPDE4APDE4C
SCHEMBL4123311 0.69 PDE4B (1.00) PDE4B
SCHEMBL14684435 0.68 PDE4B (0.71) PDE4BPDE4D
SCHEMBL14684508 0.68 PDE4B (0.71) PDE4BPDE4D
SCHEMBL4123097 0.67 PDE4B (0.70) PDE4BPDE4DPDE4A

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
US-20090318385-A1 Pyrazolopyride derivative and phosphodiesterase ( pde) inhibitors containing the same as active ingredient KYORIN PHARMACEUTICAL CO., LTD. (JP) 2009-12-24 US disclosed
US-20090318385-A1 Pyrazolopyride derivative and phosphodiesterase ( pde) inhibitors containing the same as active ingredient KYORIN PHARMACEUTICAL CO., LTD. (JP) 2009-12-24 US disclosed
US-20090318385-A1 Pyrazolopyride derivative and phosphodiesterase ( pde) inhibitors containing the same as active ingredient KYORIN PHARMACEUTICAL CO., LTD. (JP) 2009-12-24 US disclosed
EP-2060572-A1 PYRAZOLOPYRIDINE DERIVATIVE AND PHOSPHODIESTERASE (PDE) INHIBITOR CONTAINING THE SAME AS ACTIVE INGREDIENT Kyorin Pharmaceutical Co., Ltd. (JP) 2009-05-20 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 (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-20090318385-A1 Pyrazolopyride derivative and phosphodiesterase ( pde) inhibitors containing the same as active ingredient PDE3A, PDE5A, PDE3B PDE4B 18/4885PDE4D 16/4885PDE4A 7/4885

“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.