SCHEMBL3347872

SCHEMBL3347872

C#CC1=CCCCC1=NOC.c1cn2ncc3c2nc1-3

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.37
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
PRKCA P17252 1/20 0.32
PRKCI P41743 1/20 0.32
PRKCE Q02156 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PIK3CD O00329 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
SCHEMBL3350900 0.80 SMN1; SMN2 (0.34) SMN1; SMN2MAPTMEN1NPC1RAB9A
SCHEMBL3345835 0.59 MAPT (0.40) SMN1; SMN2MAPTMEN1NPC1RAB9A
SCHEMBL31398170 0.53 TGFBR1 (0.43) NPC1RAB9AL3MBTL1
SCHEMBL31398124 0.53 TGFBR1 (0.50) SMN1; SMN2MAPTMEN1NPC1RAB9A
SCHEMBL15259631 0.51 GRM5 (0.33)
SCHEMBL15259633 0.51 GRM5 (0.33)
SCHEMBL2044650 0.51 GAA (0.33) MAPTKMT2AKDM4EALDH1A1
SCHEMBL2044649 0.51 GAA (0.33) MAPTKMT2AKDM4EALDH1A1
SCHEMBL2049795 0.50 GAA (0.33) KDM4E
SCHEMBL2049793 0.50 GAA (0.33) KDM4E

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