SCHEMBL23974576

SCHEMBL23974576

Cn1c(=O)c2ncn(Cc3ccccc3)c2n(C)c1=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.63
ADORA2B P29275 1/20 0.63
RXFP1 Q9HBX9 1/20 0.63
LMNA P02545 2/20 0.62
ALDH1A1 P00352 3/20 0.54
HTT P42858 3/20 0.54
PDE1A P54750 2/20 0.53
PDE1B Q01064 2/20 0.53
PDE1C Q14123 2/20 0.53
PDE2A O00408 1/20 0.53
POLB P06746 2/20 0.52
HIF1A Q16665 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
GLA P06280 1/20 0.49
UBE2N P61088 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TSHR P16473 1/20 0.49
MAPT P10636 1/20 0.48

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
SCHEMBL21977263 0.86 LMNA (0.56) SMN1; SMN2ADORA2BRXFP1LMNAALDH1A1
SCHEMBL8649791 0.81 LMNA (0.50) SMN1; SMN2ADORA2BRXFP1LMNAALDH1A1
SCHEMBL8643199 0.80 LMNA (0.55) SMN1; SMN2ADORA2BRXFP1LMNAALDH1A1
SCHEMBL8649860 0.80 LMNA (0.55) SMN1; SMN2ADORA2BRXFP1LMNAALDH1A1
SCHEMBL8642267 0.80 LMNA (0.55) SMN1; SMN2ADORA2BRXFP1LMNAALDH1A1
SCHEMBL1962417 0.80 LMNA (0.69) ADORA2BRXFP1LMNAALDH1A1HTT
SCHEMBL8645114 0.79 LMNA (0.54) SMN1; SMN2RXFP1LMNAALDH1A1HTT
SCHEMBL8643383 0.79 LMNA (0.54) SMN1; SMN2ADORA2BRXFP1LMNAALDH1A1
Hydrochloric Acid SCHEMBL8648397 0.79 LMNA (0.54) SMN1; SMN2LMNAALDH1A1HTTPOLB
SCHEMBL8679546 0.79 LMNA (0.64) SMN1; SMN2ADORA2BRXFP1LMNAALDH1A1

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-20210344045-A1 Nonaqueous Electrolyte Solution and Nonaqueous Secondary Battery ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-11-04 US disclosed