SCHEMBL6528047

SCHEMBL6528047

O=C(O)C1CCN2CCCN12

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 8/20 0.33
REN P00797 1/20 0.32
LMNA P02545 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL10905425 0.87 ACE (0.41) ACERENLMNACYP2C19HSD17B10
SCHEMBL4963186 0.85 ACE (0.40) ACERENLMNACYP2C19HSD17B10
SCHEMBL27718628 0.85 ACE (0.40) ACERENLMNACYP2C19HSD17B10
SCHEMBL16761709 0.85 L3MBTL1 (0.37) ACE
SCHEMBL3360876 0.77 ACE (0.46) ACERENLMNACYP2C19HSD17B10
SCHEMBL7113056 0.77 ACE (0.46) ACERENLMNACYP2C19HSD17B10
SCHEMBL10905654 0.76 TSHR (0.39) ACEREN
SCHEMBL22418322 0.76 ACE (0.35) ACE
SCHEMBL29586626 0.75 GABRP (0.36) ACEREN
SCHEMBL7850459 0.72 ALDH1A1 (0.41) ACERENHSD17B10

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-20050176801-A1 Acyl bicyclic derivatives of pyrrol GLAXO GROUP LIMITED (GB) 2005-08-11 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-20050176801-A1 Acyl bicyclic derivatives of pyrrol NR1H3, NR1H2, NR1H4 ACE 4000/4885REN 1328/4885LMNA 4731/4885

“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.