SCHEMBL582289

SCHEMBL582289

COc1ccc(Cn2ncc3c(NC4CCOCC4)c(C(=O)O)cnc32)cc1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.69
ADORA1 P30542 1/20 0.51
PDE5A O76074 1/20 0.49

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
SCHEMBL583339 0.91 PDE4B (0.57) PDE4BADORA1PDE5A
SCHEMBL582502 0.90 PDE4B (0.62) PDE4BADORA1
SCHEMBL583427 0.90 PDE4B (0.83) PDE4BADORA1
SCHEMBL583433 0.89 PDE4B (0.54) PDE4BADORA1PDE5A
SCHEMBL583434 0.89 PDE4B (0.54) PDE4BADORA1PDE5A
SCHEMBL583465 0.85 PDE4B (0.56) PDE4B
SCHEMBL583243 0.83 PDE4B (0.54) PDE4B
SCHEMBL583242 0.83 PDE4B (0.54) PDE4B
SCHEMBL4343317 0.83 PDE4B (0.81) PDE4BPDE5A
SCHEMBL582853 0.83 PDE4B (0.82) PDE4B

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-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 PDE4B 5/4885ADORA1 1009/4885PDE5A 6/4885

“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.