SCHEMBL682838

SCHEMBL682838

CC1CN(Cn2c(=O)c3c(ncn3C)n(C)c2=O)CCN1C(c1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.57
DGKA P23743 1/20 0.43
DGKZ Q13574 1/20 0.43
ADORA2B P29275 5/20 0.41
SLC6A9 P48067 1/20 0.41
KMT2A Q03164 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GLA P06280 1/20 0.39
BLM P54132 1/20 0.39

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
SCHEMBL683710 0.87 HTR2A (0.73) HTR2AADORA2BKMT2A
SCHEMBL684015 0.86 LMNA (0.49) HTR2ADGKADGKZADORA2BKMT2A
SCHEMBL684071 0.80 HTR2A (0.81) HTR2AADORA2BKMT2A
SCHEMBL683669 0.78 MAPK1 (0.45) HTR2AADORA2BMAPK1NPSR1GLA
SCHEMBL683711 0.75 HTR2A (0.58) HTR2AADORA2BKMT2AMAPK1GLA
SCHEMBL684023 0.73 HTR2A (0.58) HTR2AADORA2BKMT2AMAPK1GLA
SCHEMBL683646 0.73 HTR2A (0.52) HTR2AADORA2BKMT2AMAPK1NPSR1
SCHEMBL682832 0.73 MAPT (0.49) HTR2AADORA2BKMT2AMAPK1GLA
SCHEMBL683671 0.72 HTR2A (0.54) HTR2AADORA2BKMT2AMAPK1GLA
SCHEMBL683707 0.71 ADORA2B (0.45) HTR2AADORA2BKMT2AMAPK1NPSR1

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 1201/4885DGKA 1738/4885DGKZ 3142/4885

“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.