SCHEMBL6481525

SCHEMBL6481525

NC(=O)Cn1cnc2cnc(-c3ccccc3)nc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.42
F2 P00734 3/20 0.42
PRSS1 P07477 2/20 0.42
HDAC6 Q9UBN7 1/20 0.40
PDE4B Q07343 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSPO P30536 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
EGFR P00533 1/20 0.39
PTGS2 P35354 1/20 0.39
PARP1 P09874 1/20 0.39
PRNP P04156 1/20 0.38
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL6948678 0.80 ADORA2A (0.41) F2HDAC6KMT2AALDH1A1MAPK1
SCHEMBL6948592 0.70 FDPS (0.55) HDAC6MEN1KMT2ANPC1ALDH1A1
SCHEMBL10423399 0.70 MEN1 (0.56) MEN1KMT2ANPC1TP53KDM4E
SCHEMBL1038315 0.69 KDM4E (0.69) SMN1; SMN2NPC1KDM4ELMNA
SCHEMBL30052297 0.69 HDAC6 (0.54) HDAC6ALDH1A1EGFRPTGS2KDM4E
SCHEMBL452417 0.69 HDAC6 (0.54) HDAC6ALDH1A1EGFRPTGS2KDM4E
SCHEMBL1950890 0.67 CYP11B1 (0.57) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL14736671 0.67 HDAC1 (0.53) HDAC6ALDH1A1MAPTLMNA
SCHEMBL3118173 0.66 SMN1; SMN2 (0.69) MEN1KMT2ASMN1; SMN2NPC1ALDH1A1
SCHEMBL28184787 0.66 FGFR1 (0.45) HDAC6ALDH1A1PTGS2KDM4ELMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6962921-B2 Dementia remedies containing 2-aryl-8-oxodihydropurine derivatives as the active ingredient DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2005-11-08 US disclosed