SCHEMBL683897

SCHEMBL683897

CCN(CC)CCCCn1cnc2c1c(=O)n(C)c(=O)n2C

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 12/20 0.71
RXFP1 Q9HBX9 2/20 0.64
MAPK1 P28482 1/20 0.64
LMNA P02545 2/20 0.62
MAPT P10636 1/20 0.62
TSHR P16473 1/20 0.60
ADORA2A P29274 2/20 0.56
ALDH1A1 P00352 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
PDE4A P27815 1/20 0.53
PDE4B Q07343 1/20 0.53
PDE4C Q08493 1/20 0.53
PDE4D Q08499 1/20 0.53

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
SCHEMBL683551 0.96 ADORA2B (0.70) ADORA2BRXFP1MAPK1LMNAMAPT
Etamiphyllin SCHEMBL355304 0.90 ADORA2B (0.67) ADORA2BRXFP1MAPK1LMNAMAPT
SCHEMBL16120975 0.89 ADORA2B (0.88) ADORA2BRXFP1MAPK1LMNAMAPT
SCHEMBL684274 0.88 ADORA2B (0.67) ADORA2BRXFP1MAPK1LMNAMAPT
Etamiphyllin SCHEMBL1651150 0.88 ADORA2B (0.63) ADORA2BRXFP1MAPK1LMNAMAPT
SCHEMBL31482443 0.87 ADORA2B (0.81) ADORA2BRXFP1MAPK1LMNAMAPT
SCHEMBL16120983 0.87 ADORA2B (0.85) ADORA2BRXFP1MAPK1LMNAMAPT
SCHEMBL16120989 0.87 ADORA2B (0.85) ADORA2BRXFP1MAPK1LMNAMAPT
SCHEMBL16120999 0.87 ADORA2B (0.85) ADORA2BRXFP1MAPK1LMNAMAPT
SCHEMBL16120982 0.87 ADORA2B (0.85) ADORA2BRXFP1MAPK1LMNAMAPT

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
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 US disclosed
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF ADORA2B 786/4885RXFP1 211/4885MAPK1 470/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.