SCHEMBL15835049

SCHEMBL15835049

[2H]C[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@H]1O[PH](=O)O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TK1 P04183 7/20 0.53
RNASE1 P07998 1/20 0.48
DHFR P00374 1/20 0.47

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
SCHEMBL774219 1.00 TK1 (0.53) TK1RNASE1DHFR
SCHEMBL14867212 0.83 TK1 (0.57) TK1RNASE1
SCHEMBL15448880 0.83 TK1 (0.57) TK1RNASE1
SCHEMBL19401569 0.83 TK1 (0.51) TK1RNASE1DHFR
SCHEMBL22912046 0.83 TK1 (0.51) TK1RNASE1DHFR
SCHEMBL19397221 0.83 TK1 (0.51) TK1RNASE1DHFR
SCHEMBL19397222 0.83 TK1 (0.51) TK1RNASE1DHFR
SCHEMBL22912041 0.83 TK1 (0.51) TK1RNASE1DHFR
SCHEMBL19401568 0.83 TK1 (0.51) TK1RNASE1DHFR
SCHEMBL19928644 0.82 TK1 (0.57) TK1RNASE1

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-20140179875-A1 SULFURIZATION REAGENTS ON SOLID SUPPORTS GIRINDUS AMERICA, INC. (US) 2014-06-26 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-20140179875-A1 SULFURIZATION REAGENTS ON SOLID SUPPORTS OR10J3, RPS8, NSUN2 TK1 2907/4885RNASE1 2182/4885DHFR 1025/4885

“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.