SCHEMBL19174678

SCHEMBL19174678

O=c1[nH]c(=O)n([C@@H]2CC[C@@H](CO[PH](=O)O)O2)cc1I

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TK1 P04183 7/20 0.48
PYGM P11217 1/20 0.44
P2RY6 Q15077 4/20 0.44
P2RY14 Q15391 3/20 0.44
BCHE P06276 3/20 0.40

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
SCHEMBL7518214 0.87 BCHE (0.52) TK1BCHE
SCHEMBL24516961 0.87 BCHE (0.52) TK1BCHE
SCHEMBL4786342 0.83 TK1 (0.49) TK1PYGMP2RY6P2RY14BCHE
SCHEMBL5898590 0.82 TK1 (0.62) TK1PYGM
SCHEMBL14231186 0.82 TK1 (0.62) TK1PYGM
SCHEMBL2043148 0.82 TK1 (0.62) TK1PYGM
SCHEMBL4438998 0.80 TK1 (0.47) TK1PYGMP2RY6P2RY14BCHE
SCHEMBL4438991 0.80 TK1 (0.47) TK1PYGMP2RY6P2RY14BCHE
SCHEMBL13968218 0.80 TK1 (0.46) TK1PYGMP2RY6P2RY14BCHE
SCHEMBL12914128 0.79 SLC28A1 (0.43) P2RY6P2RY14

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-10844430-B2 DNA sequencing reaction additive QIAGEN SCIENCES, LLC (US) 2020-11-24 US disclosed
US-20190226018-A1 SEQUENCING ADDITIVE IsoPlexis Corporation 2019-07-25 US disclosed
US-20170211134-A1 THIOL-CONTAINING CLEAVE REAGENTS AND OXIDATIVE WASH IsoPlexis Corporation 2017-07-27 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 (2 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-10844430-B2 DNA sequencing reaction additive RNGTT, NSUN2, NT5C3B TK1 143/4885PYGM 4054/4885P2RY6 906/4885
US-20190226018-A1 SEQUENCING ADDITIVE NT5C3B, RNGTT, NSUN2 TK1 143/4885PYGM 4067/4885P2RY6 793/4885

“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.