SCHEMBL684023

SCHEMBL684023

Cn1cnc2c1c(=O)n(CN1CCN(c3ccccc3)CC1)c(=O)n2C

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.58
HTR7 P34969 1/20 0.57
HTR6 P50406 1/20 0.57
ADORA2B P29275 5/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
GLA P06280 1/20 0.50
BLM P54132 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPK1 P28482 1/20 0.48
TSHR P16473 2/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD17B10 Q99714 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
SCHEMBL682830 0.90 ADORA2B (0.50) HTR2AHTR7HTR6ADORA2BGLA
SCHEMBL684026 0.88 MAPK1 (0.49) HTR2AHTR7HTR6ADORA2BGLA
SCHEMBL683652 0.88 MAPK1 (0.55) HTR2AGLAMAPK1TSHRALDH1A1
SCHEMBL684375 0.87 ADORA2B (0.53) HTR2AADORA2BKMT2AMAPK1TSHR
SCHEMBL684068 0.87 ADORA2B (0.50) HTR2AHTR7ADORA2BMAPK1
SCHEMBL683668 0.86 ADORA2B (0.49) HTR2AADORA2BGLABLM
SCHEMBL684062 0.86 HTR2A (0.52) HTR2AADORA2BGLABLMKMT2A
SCHEMBL684065 0.86 HTR2A (0.52) HTR2AHTR7ADORA2BGLABLM
SCHEMBL683646 0.86 HTR2A (0.52) HTR2AADORA2BGLABLMKMT2A
SCHEMBL684377 0.86 MAPK1 (0.47) HTR2AHTR7HTR6ADORA2BGLA

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 HTR2A 1201/4885HTR7 1398/4885HTR6 683/4885

“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.