SCHEMBL19153764

SCHEMBL19153764

Cc1n[nH]c(=O)c2c1C[S+]([O-])CC2

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 2/20 0.31
▸ PDPK1 O15530 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
SCHEMBL19153766 0.93 PDPK1 (0.30) PDPK1
SCHEMBL19153229 0.77 — —
SCHEMBL18238481 0.76 PARP1 (0.34) PARP1
SCHEMBL22743476 0.72 PARP1 (0.45) PARP1
SCHEMBL19902649 0.72 PARP1 (0.42) PARP1
SCHEMBL19413424 0.71 MAPT (0.35) —
SCHEMBL19153186 0.69 PARP1 (0.33) PARP1PDPK1
SCHEMBL19153066 0.69 PDPK1 (0.33) PARP1PDPK1
SCHEMBL19152697 0.67 MEN1 (0.39) PARP1PDPK1
SCHEMBL7783313 0.66 PARP1 (0.50) PARP1

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-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2017-07-20 — — 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-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT PARP1 2195/4885PDPK1 2826/4885

“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.

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