SCHEMBL3345883

SCHEMBL3345883

C(#Cc1ccn2nccc2n1)Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.37
GRM5 P41594 5/20 0.36
OGA O60502 1/20 0.36
DHFR P00374 1/20 0.34
SCN5A Q14524 1/20 0.33
KCNN1 Q92952 1/20 0.33
KCNN2 Q9H2S1 1/20 0.33
KCNN3 Q9UGI6 1/20 0.33
CYP19A1 P11511 1/20 0.33
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
TGFBR1 P36897 1/20 0.31
P2RX7 Q99572 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
SCHEMBL3346817 0.84 DYRK1A (0.41) DYRK1AOGADHFRCYP19A1TGFBR1
SCHEMBL3346876 0.82 CYP19A1 (0.42) CYP19A1
SCHEMBL3345949 0.81 GRM5 (0.42) GRM5
SCHEMBL3347519 0.80 GRM4 (0.46) DYRK1AGRM5
SCHEMBL3347027 0.75 GRM5 (0.50) DYRK1AGRM5TGFBR1
SCHEMBL3346390 0.75 DYRK1A (0.36) DYRK1AGRM5SCN5A
SCHEMBL3416442 0.74 KCNH2 (0.41) DYRK1AGRM5OGAFFAR1FFAR4
SCHEMBL3346551 0.72 DYRK1A (0.35) DYRK1AOGASCN5ATGFBR1
SCHEMBL3347276 0.72 DYRK1A (0.35) DYRK1AGRM5OGADHFRSCN5A
SCHEMBL3347789 0.72 GRM5 (0.49) DYRK1AGRM5OGASCN5ATGFBR1

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