SCHEMBL3351360

SCHEMBL3351360

C#Cc1ccccc1C=O.c1cn2ncc3c2nc1-3

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
CAMKK1 Q8N5S9 1/20 0.35
CAMKK2 Q96RR4 1/20 0.35
PIM1 P11309 3/20 0.34
TGFBR1 P36897 5/20 0.34
PIK3CD O00329 3/20 0.34
PIK3R1 P27986 1/20 0.32
JAK2 O60674 1/20 0.32
NTRK1 P04629 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
KCNH2 Q12809 1/20 0.32
ALDH1A1 P00352 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL3347267 0.81 TGFBR1 (0.45) MAPTSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL3345835 0.78 MAPT (0.40) MAPTSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL3347002 0.76 MEN1 (0.40) MAPTSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL3348254 0.75 EPHB3 (0.42) MEN1NPC1RAB9AKMT2ACAMKK1
SCHEMBL711033 0.72 LMNA (0.55) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL3346812 0.71 PIM1 (0.40) MAPTSMN1; SMN2MEN1NPC1RAB9A
Benzene SCHEMBL28197607 0.71 LMNA (0.52) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL860236 0.70 PARP1 (0.43) MAPTSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL29220732 0.69 CAMKK1 (0.44) MAPTSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL3045043 0.68 LMNA (0.48) SMN1; SMN2MEN1NPC1RAB9AKMT2A

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