SCHEMBL3346767

SCHEMBL3346767

C(#Cc1ccn2nccc2n1)c1ccsc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 7/20 0.46
CYP2A6 P11509 1/20 0.44
DYRK1A Q13627 1/20 0.35
OGA O60502 1/20 0.35
NPC1 O15118 3/20 0.32
RAB9A P51151 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SCN5A Q14524 1/20 0.32
HCRTR1 O43613 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
SCHEMBL3347519 0.80 GRM4 (0.46) GRM5DYRK1ANPC1RAB9AMEN1
SCHEMBL3347789 0.79 GRM5 (0.49) GRM5DYRK1AOGANPC1RAB9A
SCHEMBL3346476 0.78 DYRK1A (0.41) GRM5CYP2A6DYRK1ATDP1L3MBTL1
SCHEMBL3347283 0.77 CYP2A6 (0.36) GRM5CYP2A6DYRK1A
SCHEMBL3351686 0.77 GRM5 (0.49) GRM5DYRK1AOGASCN5A
SCHEMBL3346384 0.77 GRM5 (0.43) GRM5DYRK1AOGANPC1RAB9A
SCHEMBL3346603 0.77 GRM5 (0.41) GRM5DYRK1AOGANPC1RAB9A
SCHEMBL3346523 0.76 CYP2A6 (0.35) GRM5CYP2A6DYRK1ASCN5A
SCHEMBL3348818 0.75 GRM5 (0.47) GRM5DYRK1AOGASCN5A
SCHEMBL3345958 0.75 GRM5 (0.52) GRM5CYP2A6

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