SCHEMBL16248687

SCHEMBL16248687

C=P(OC)(OC)OCCC#N

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL16248659 0.88
SCHEMBL10158994 0.86
SCHEMBL18291793 0.80
SCHEMBL23772196 0.76
SCHEMBL16692083 0.74
SCHEMBL11907935 0.73 CYP3A4 (0.34) ALDH1A1TDP1
SCHEMBL11237347 0.71
SCHEMBL18291794 0.70 BTN3A1 (0.32)
SCHEMBL14960582 0.70 ACHE (0.31)
SCHEMBL16575292 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160354476-A1 TARGETED THERAPEUTIC NUCLEOSIDES AND THEIR USE IONIS PHARMACEUTICALS, INC. (US) 2016-12-08 US disclosed
US-9127276-B2 Conjugated antisense compounds and their use ISIS PHARMACEUTICALS, INC. (US) 2015-09-08 US disclosed
US-20140343123-A1 CONJUGATED ANTISENSE COMPOUNDS AND THEIR USE ISIS PHARMACEUTICALS, INC. (US) 2014-11-20 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-20160354476-A1 TARGETED THERAPEUTIC NUCLEOSIDES AND THEIR USE FUT6, GALNT6, FUT5 ALDH1A1 1445/4885TDP1 658/4885

“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.