SCHEMBL6464368

SCHEMBL6464368

CCn1cc(N(Cc2ccccc2C(N)=O)C2CCCCC2)cn1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.41
JAK3 P52333 18/20 0.40
JAK2 O60674 16/20 0.40
JAK1 P23458 13/20 0.40
TYK2 P29597 1/20 0.38

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
SCHEMBL6456034 0.81 TGFBR1 (0.41) TGFBR1JAK3JAK2JAK1
SCHEMBL6461886 0.81 TGFBR1 (0.41) TGFBR1JAK3JAK2JAK1
SCHEMBL6458237 0.79 TGFBR1 (0.41) TGFBR1JAK3JAK2JAK1
SCHEMBL6453841 0.78 SLC6A2 (0.39)
SCHEMBL6440581 0.73 LMNA (0.41) TGFBR1
SCHEMBL6450611 0.73 SLC6A2 (0.40) TGFBR1
SCHEMBL6454933 0.72 TP53 (0.37) TGFBR1
SCHEMBL6451777 0.70 KMT2A (0.38) TGFBR1JAK3JAK2JAK1
SCHEMBL6450409 0.70 MAPK1 (0.40)
SCHEMBL6456250 0.68 KMT2A (0.39) TGFBR1JAK3JAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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