SCHEMBL3764865

SCHEMBL3764865

CCC(CC(C)c1ccc2[nH]cc(CCCOC)c2c1)CC(N)C1CC(C(C)C)C(=O)O1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 10/20 0.35
HTR1B P28222 10/20 0.34
HTR1A P08908 5/20 0.33
MTNR1B P49286 1/20 0.31
HTR2A P28223 3/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31

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
SCHEMBL3770009 0.87 HTR1D (0.36) HTR1DHTR1BHTR1AHTR2AHTR2C
SCHEMBL3767892 0.81 HTR1D (0.31) HTR1DHTR1B
SCHEMBL3764867 0.79 HTR1D (0.36) HTR1DHTR1BHTR1AMTNR1BHTR2A
SCHEMBL4533872 0.75 HTR1D (0.31) HTR1DHTR1B
SCHEMBL3772837 0.73 CAPN1 (0.34) HTR1DHTR1BHTR1A
SCHEMBL3770818 0.71 HTR1D (0.30) HTR1DHTR1B
SCHEMBL78477 0.69 HTR1D (0.66) HTR1DHTR1BHTR1AHTR2AHTR2C
SCHEMBL3465851 0.68
SCHEMBL4756458 0.68
SCHEMBL4757234 0.68

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-7851634-B2 5-amino 4-hydroxy-7-(1H-indolmethyl)-8-methylnonamide derivatives as renin inhibitors for the treatment of hypertension NOVARTIS AG (CH) 2010-12-14 US disclosed
US-20080280895-A1 5-Amino-4-Hydroxy-7-(1H-Indolmethyl)-8-Methylnonamide Derivatives as Renin Inhibitors for the Treatment of Hypertension NOVARTIS AG (CH) 2008-11-13 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-20080280895-A1 5-Amino-4-Hydroxy-7-(1H-Indolmethyl)-8-Methylnonamide Derivatives as Renin Inhibitors for the Treatment of Hypertension REN, AGTR1, AGTR2 HTR1D 197/4885HTR1B 213/4885HTR1A 202/4885

“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.