SCHEMBL4552449

SCHEMBL4552449

CCc1nn(CC)cc1NC1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PDE7A Q13946 7/20 0.37
PDE4B Q07343 5/20 0.37
LRRK2 Q5S007 1/20 0.34
AOC1 P19801 1/20 0.33
AOC3 Q16853 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
KAT2B Q92831 1/20 0.33
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
CCND2 P30279 1/20 0.33
CCND3 P30281 1/20 0.33

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
SCHEMBL4555150 0.98 RAB9A (0.42) RAB9ASMN1; SMN2PDE7APDE4BLRRK2
SCHEMBL4762000 0.94 ALDH1A1 (0.35) RAB9ASMN1; SMN2PDE7APDE4BALDH1A1
SCHEMBL5176743 0.87 PDE4B (0.39) PDE7APDE4BLRRK2
SCHEMBL5185734 0.87 PDE7A (0.39) RAB9ASMN1; SMN2PDE7APDE4BALDH1A1
SCHEMBL3422561 0.83 LMNA (0.38) SMN1; SMN2PDE7APDE4BAOC1AOC3
SCHEMBL5175998 0.81 BPTF (0.41)
SCHEMBL6450335 0.79 KHK (0.31)
SCHEMBL4554789 0.76 ALDH1A1 (0.49) RAB9AALDH1A1
SCHEMBL6437921 0.75 PDE4B (0.40) PDE7APDE4BLRRK2
SCHEMBL6469770 0.73 KAT2B (0.36) KAT2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2124944-A1 PYRAZOLO (3, 4-B) PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2009-12-02 EP disclosed
EP-2124943-A1 PYRAZOLO [3, 4-B]PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2009-12-02 EP disclosed
WO-2008111010-A1 PYRAZOLO (3, 4-B) PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2008-09-18 WO disclosed
WO-2008111009-A1 PYRAZOLO [3, 4-B] PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2008-09-18 WO disclosed
EP-1934219-A1 SUBSTITUTED PYRAZOLO [3,4-B] PYRIDINES AS PHOSPHODIESTERASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2008-06-25 EP disclosed
EP-1931668-A2 SUBSTITUTED PYRAZOLO [3,4-B]PYRIDINES AS PHOSPHODIESTERASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2008-06-18 EP disclosed
WO-2007031838-A1 SUBSTITUTED PYRAZOLO [3,4-B] PYRIDINES AS PHOSPHODIESTERASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2007-03-22 WO disclosed
WO-2007031977-A2 SUBSTITUTED PYRAZOLO [3,4-B]PYRIDINES AS PHOSPHODIESTERASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2007-03-22 WO disclosed
EP-1539753-A2 PYRAZOLO(3,4-B)PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-06-15 EP disclosed
WO-2004024728-A2 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-03-25 WO disclosed