SCHEMBL3351201

SCHEMBL3351201

Cn1ccnc1C#Cc1ccn2nccc2n1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OGA O60502 1/20 0.37
PDE10A Q9Y233 4/20 0.36
DYRK1A Q13627 1/20 0.35
SCN5A Q14524 1/20 0.35
TGFBR1 P36897 3/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
HAO1 Q9UJM8 2/20 0.32
KMT2A Q03164 1/20 0.31
MET P08581 1/20 0.30
PIK3CD O00329 1/20 0.30
FGFR2 P21802 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
SCHEMBL3347027 0.76 GRM5 (0.50) DYRK1ATGFBR1
SCHEMBL3346766 0.75 GRM5 (0.53) PDE10ATGFBR1KMT2A
SCHEMBL3347519 0.74 GRM4 (0.46) DYRK1AKMT2A
SCHEMBL15871038 0.74 LPO (0.48) PTGDR2HAO1KMT2A
SCHEMBL3346384 0.74 GRM5 (0.43) OGAPDE10ADYRK1ATGFBR1KMT2A
SCHEMBL3347789 0.73 GRM5 (0.49) OGAPDE10ADYRK1ASCN5ATGFBR1
SCHEMBL3346192 0.72 GRM5 (0.47) OGAPDE10ADYRK1ASCN5ATGFBR1
SCHEMBL3348313 0.72 OGA (0.36) OGADYRK1ASCN5ATGFBR1FGFR2
SCHEMBL3346563 0.72 CYP2A6 (0.45) OGADYRK1ASCN5ATGFBR1
SCHEMBL3346568 0.71 GRM5 (0.43) OGADYRK1ASCN5ATGFBR1PIK3CD

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
WO-2010063487-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2010-06-10 WO claimed
WO-2010063487-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2010-06-10 WO disclosed