SCHEMBL6019646

SCHEMBL6019646

[O]CCN1CCNCC1CCO

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA4 P22748 2/20 0.42
CA9 Q16790 2/20 0.42
TAAR1 Q96RJ0 1/20 0.36
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MITF O75030 1/20 0.31
APAF1 O14727 1/20 0.30
IDE P14735 1/20 0.30

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
SCHEMBL366506 0.87 CA1 (0.42) CA1CA2CA4CA9TAAR1
SCHEMBL22284794 0.85 CA1 (0.33) CA1CA2CA4CA9TAAR1
SCHEMBL31397702 0.84 TAAR1 (0.45) CA1CA2CA4CA9TAAR1
Sulfuric Acid SCHEMBL28700686 0.83 CA1 (0.46) CA1CA2CA4CA9TAAR1
SCHEMBL10385184 0.83 CA1 (0.42) CA1CA2CA4CA9TAAR1
SCHEMBL29447126 0.83 CA1 (0.39) CA1CA2CA4CA9TAAR1
SCHEMBL83681 0.81 CA1 (0.44) CA1CA2CA4CA9TAAR1
SCHEMBL2638396 0.81 TAAR1 (0.42) CA1CA2CA4CA9TAAR1
SCHEMBL28480031 0.81 TAAR1 (0.42) CA1CA2CA4CA9TAAR1
SCHEMBL31006957 0.80 CA1 (0.41) CA1CA2CA4CA9TAAR1

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-20060270692-A1 Chemical compounds ASTRAZENECA AB (SE) 2006-11-30 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-20060270692-A1 Chemical compounds CCNI, MKI67, TP53 CA1 4363/4885CA2 2154/4885CA4 1081/4885

“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.