SCHEMBL19246232

SCHEMBL19246232

CCCOC1/C=C/CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 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
SCHEMBL10169614 0.92 CYP1A2 (0.31) CYP1A2CYP2D6CYP2C19
SCHEMBL10911395 0.85
SCHEMBL10911397 0.85
SCHEMBL11328512 0.84
SCHEMBL19205997 0.81
SCHEMBL19205999 0.81
SCHEMBL20624694 0.81
SCHEMBL10304159 0.81 SMN1; SMN2 (0.32)
SCHEMBL17528454 0.81
SCHEMBL23254933 0.81 SIGMAR1 (0.33)

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-20170233365-A1 CYCLOOCTENES FOR BIOORTHOGONOL REACTIONS THE GENERAL HOSPITAL CORPORATION 2017-08-17 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-20170233365-A1 CYCLOOCTENES FOR BIOORTHOGONOL REACTIONS SQLE, BBOX1, TKT CYP1A2 119/4885CYP2D6 93/4885CYP2C19 215/4885

“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.