SCHEMBL4552645

SCHEMBL4552645

CCc1c(NC2CC2)c(C)nn1C

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SMYD3 Q9H7B4 1/20 0.31
FPR2 P25090 1/20 0.31
PROKR1 Q8TCW9 1/20 0.31
PDE4B Q07343 1/20 0.30

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
SCHEMBL4553902 0.93 SMN1; SMN2 (0.35) POLBLMNAHTTSMN1; SMN2PDE4B
SCHEMBL2612158 0.69 GAA (0.40) LMNAHTTSMN1; SMN2
SCHEMBL22572879 0.68 NMT1 (0.41) POLBFPR2PROKR1
SCHEMBL22573154 0.67 MAPK1 (0.44) FPR2PROKR1PDE4B
SCHEMBL23402164 0.65 KDM4E (0.33) LMNAHTTSMN1; SMN2
SCHEMBL14996544 0.65 GAA (0.32) LMNAHTTSMN1; SMN2
SCHEMBL7357745 0.65 KDM4E (0.43) LMNASMN1; SMN2
SCHEMBL13990830 0.65 SMN1; SMN2 (0.38) LMNAHTTSMN1; SMN2
SCHEMBL13942645 0.63 GAA (0.31)
SCHEMBL17717957 0.62 GAA (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2124943-A1 PYRAZOLO [3, 4-B]PYRIDINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2009-12-02 EP 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