SCHEMBL3431032

SCHEMBL3431032

CN1CCNCC1COP(=O)(O)O

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.34
AURKB Q96GD4 1/20 0.34
FBP1 P09467 1/20 0.33

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
SCHEMBL1922084 0.77 SLC6A2 (0.41) SYKAURKB
SCHEMBL15134687 0.77 SLC6A2 (0.41) SYKAURKB
SCHEMBL3436800 0.77 SLC6A2 (0.41) SYKAURKB
Hydrochloric Acid SCHEMBL9582248 0.75 CYP2D6 (0.40) SYKAURKB
Hydrochloric Acid SCHEMBL31535360 0.75 CYP2D6 (0.40) SYKAURKB
Hydrochloric Acid SCHEMBL31535515 0.75 CYP2D6 (0.40) SYKAURKB
Hydrochloric Acid SCHEMBL16195604 0.75 CYP2D6 (0.40) SYKAURKB
SCHEMBL2668528 0.75 SYK (0.35) SYKAURKB
SCHEMBL25019687 0.74 CHRNB2 (0.48)
SCHEMBL13531684 0.74 CHRNB2 (0.48)

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691867-B2 Chemical compounds ASTRAZENECA AB (SE) 2010-04-06 US disclosed
EP-1613619-B1 QUINAZOLINE DERIVATIVES FOR TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-03-26 EP disclosed
US-20060270692-A1 Chemical compounds ASTRAZENECA AB (SE) 2006-11-30 US disclosed
EP-1613619-A1 QUINAZOLINE DERIVATIVES FOR TREATMENT OF CANCER AstraZeneca AB (SE) 2006-01-11 EP disclosed
WO-2004094410-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2004-11-04 WO 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 SYK 3464/4885AURKB 369/4885FBP1 1916/4885

“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.