SCHEMBL684377

SCHEMBL684377

CCOc1cccc(N2CCN(Cn3c(=O)c4c(ncn4C)n(C)c3=O)CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.47
ADORA2B P29275 3/20 0.47
HTR2A P28223 1/20 0.46
TNF P01375 3/20 0.46
HTR7 P34969 1/20 0.43
HTR6 P50406 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GLA P06280 1/20 0.43
BLM P54132 1/20 0.43

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
SCHEMBL684068 0.91 ADORA2B (0.50) MAPK1ADORA2BHTR2AHTR7
SCHEMBL683668 0.89 ADORA2B (0.49) ADORA2BHTR2ATNFGLABLM
SCHEMBL684026 0.87 MAPK1 (0.49) MAPK1ADORA2BHTR2AHTR7HTR6
SCHEMBL683652 0.87 MAPK1 (0.55) MAPK1HTR2ATNFALDH1A1MAPT
SCHEMBL684023 0.86 HTR2A (0.58) MAPK1ADORA2BHTR2AHTR7HTR6
SCHEMBL683657 0.84 DRD2 (0.51) MAPK1HTR2AHTR7ALDH1A1
SCHEMBL684005 0.83 HTR7 (0.58) MAPK1TNFHTR7HTR6ALDH1A1
SCHEMBL683665 0.82 ADORA2B (0.47) MAPK1ADORA2BHTR2ATNFSMN1; SMN2
SCHEMBL684375 0.82 ADORA2B (0.53) MAPK1ADORA2BHTR2AALDH1A1MAPT
SCHEMBL683653 0.81 ADRA1D (0.52) MAPK1ADORA2BHTR2ATNFSMN1; SMN2

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-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 MAPK1 470/4885ADORA2B 786/4885HTR2A 1201/4885

“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.