SCHEMBL583123

SCHEMBL583123

CCn1nc(C)c2c(NC3CCS(O)(O)CC3)c(C3=NOC4(CCC(C(N)=O)CC4)C3)cnc21

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
PDE4B Q07343 8/20 0.34
PDE7A Q13946 1/20 0.34
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KMT2A Q03164 1/20 0.31

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
SCHEMBL582967 0.95 POLB (0.45) POLBPDE4BPDE7AATML3MBTL1
SCHEMBL583674 0.94 POLB (0.46) POLBPDE4BPDE7AKMT2A
SCHEMBL583157 0.93 POLB (0.44) POLBPDE4BPDE7AKMT2A
Bicarbonate SCHEMBL583229 0.92 POLB (0.46) POLBPDE4BPDE7AATML3MBTL1
SCHEMBL582175 0.91 POLB (0.46) POLBPDE4BPDE7AKMT2A
SCHEMBL583228 0.91 POLB (0.47) POLBPDE4BPDE7AATML3MBTL1
SCHEMBL582246 0.91 POLB (0.44) POLBPDE4BPDE7A
SCHEMBL583150 0.91 POLB (0.45) POLBPDE4BPDE7AKMT2A
SCHEMBL583417 0.91 POLB (0.45) POLBPDE4BPDE7AKMT2A
SCHEMBL583673 0.88 POLB (0.46) POLBPDE4BPDE7AKMT2A

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-2124944-B1 Pyrazolo[3,4-b]pyridine derivatives as phosphodiesterase inhibitors RANBAXY LAB LTD (IN) 2012-02-15 EP claimed
US-8420666-B2 Pyrazolo (3, 4-B) pyridine derivatives as phosphodiesterase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2013-04-16 US disclosed
EP-2124944-B1 Pyrazolo[3,4-b]pyridine derivatives as phosphodiesterase inhibitors RANBAXY LAB LTD (IN) 2012-02-15 EP disclosed
US-20100292196-A1 PYRAZOLO (3, 4-B) PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2010-11-18 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-20100292196-A1 PYRAZOLO (3, 4-B) PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS PDE3B, PDE4A, PDE3A POLB 1725/4885PDE4B 5/4885PDE7A 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.