SCHEMBL1944480

SCHEMBL1944480

CCn1nc(C)c2c(NC3CCOCC3)c(C3=NOC(CO)(CO)C3)cnc21

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
PDE4B Q07343 18/20 0.41
PDE3B Q13370 1/20 0.38
PDE7A Q13946 1/20 0.38
PDE3A Q14432 1/20 0.38

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
SCHEMBL1944184 0.90 POLB (0.46) POLBPDE4BPDE3BPDE7APDE3A
SCHEMBL1944198 0.89 POLB (0.48) POLBPDE4BPDE3BPDE7APDE3A
SCHEMBL1944188 0.89 POLB (0.47) POLBPDE4BPDE7A
SCHEMBL1944043 0.88 POLB (0.47) POLBPDE4BPDE3BPDE7APDE3A
SCHEMBL1944592 0.88 POLB (0.51) POLBPDE4BPDE7A
SCHEMBL582913 0.86 POLB (0.46) POLBPDE4BPDE3BPDE7APDE3A
SCHEMBL1944628 0.86 POLB (0.46) POLBPDE4B
SCHEMBL582195 0.86 POLB (0.45) POLBPDE4BPDE3BPDE7APDE3A
SCHEMBL583007 0.86 POLB (0.45) POLBPDE4BPDE3BPDE7APDE3A
SCHEMBL582863 0.85 POLB (0.45) POLBPDE4BPDE3BPDE7APDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110130403-A1 PYRAZOLO [3, 4-B] PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2011-06-02 US claimed
US-20110130403-A1 PYRAZOLO [3, 4-B] PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2011-06-02 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-20110130403-A1 PYRAZOLO [3, 4-B] PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS PDE4A, PDE3B, PDE4B POLB 1829/4885PDE4B 3/4885PDE3B 2/4885

“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.