SCHEMBL9835005

SCHEMBL9835005

CCn1ncc2c(Cl)c(C(C)=O)cnc21

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 12/20 0.61
PDE4B Q07343 7/20 0.56
PGR P06401 1/20 0.56
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
BLM P54132 1/20 0.48
PMP22 Q01453 1/20 0.48
KMT2A Q03164 1/20 0.48
PDE5A O76074 2/20 0.46

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
SCHEMBL582299 0.88 NR3C1 (0.61) NR3C1PDE4BPGRMEN1MAPT
SCHEMBL3282653 0.88 NR3C1 (0.61) NR3C1PDE4BPGRMEN1MAPT
Hydrochloric Acid SCHEMBL7008243 0.87 NR3C1 (0.60) NR3C1PDE4BPGRMEN1MAPT
SCHEMBL4338013 0.87 NR3C1 (0.60) NR3C1PDE4BPGRMEN1MAPT
SCHEMBL4341828 0.85 NR3C1 (0.71) NR3C1PDE4BPGRPDE5A
SCHEMBL14115715 0.84 PDE4B (0.52) NR3C1PDE4BPGRMEN1MAPT
SCHEMBL582528 0.83 PDE4B (0.65) NR3C1PDE4BPGRMEN1MAPT
SCHEMBL9835287 0.81 NR3C1 (0.67) NR3C1PDE4BPGR
SCHEMBL9835965 0.81 NR3C1 (0.60) NR3C1PDE4BPGRPDE5A
SCHEMBL4339500 0.81 PDE4B (0.60) NR3C1PDE4BPGRPDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709497-B2 Pyrazolo[3,4-b]pyridine compound, and its use as a PDE4 inhibitor GLAXO GROUP LIMITED (GB) 2010-05-04 US disclosed
US-20080275078-A1 Pyrazolo[3,4-B] Pyridine Compounds and Their Use as Pde4 Inhibitors GLAXO GROUP LIMITED (GB) 2008-11-06 US disclosed
US-20080175914-A1 Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors GLAXO GROUP LIMITED 2008-07-24 US disclosed
US-20070280971-A1 Pyrazolo[3,4-B]Pyridine Compound, and Its Use as a Pde4 Inhibitor GLAXO GROUP LIMITED (GB) 2007-12-06 US disclosed
EP-0230016-B1 6H-Isoxazolo[3,4-d]pyrazolo[3,4-b]pyridines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-09-11 EP disclosed
EP-0230016-A1 6H-Isoxazolo[3,4-d]pyrazolo[3,4-b]pyridines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1987-07-29 EP disclosed
US-4624955-A 6H-isoxazolo[3,4-d]pyrazolo[3,4-b]pyridines, method for their preparation and use as anxiolytic agents HOECHST-ROUSSEL PHARMACEUTICALS (US) 1986-11-25 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 (3 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-20080275078-A1 Pyrazolo[3,4-B] Pyridine Compounds and Their Use as Pde4 Inhibitors PDE4B, PDE3B, PDE4A NR3C1 964/4885PDE4B 1/4885PGR 2685/4885
US-20080175914-A1 Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors PDE5A, PDE3B, PDE4A NR3C1 16/4885PDE4B 4/4885PGR 566/4885
US-20070280971-A1 Pyrazolo[3,4-B]Pyridine Compound, and Its Use as a Pde4 Inhibitor PDE4B, PDE4A, PDE3B NR3C1 2148/4885PDE4B 1/4885PGR 3588/4885

“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.