SCHEMBL24730302

SCHEMBL24730302

C#CCCCSSCO[C@@H]1C[C@H](n2cc(C)c(=O)[nH]c2=O)OC1CCO

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TK1 P04183 8/20 0.51
RNASE1 P07998 1/20 0.47
TK2 O00142 1/20 0.44
ALB P02768 1/20 0.44
PKM P14618 1/20 0.44
LMNA P02545 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL23200257 0.93 TK1 (0.55) TK1RNASE1TK2ALBPKM
SCHEMBL23199530 0.84 POLB (0.58) TK1
SCHEMBL21787100 0.81 TK1 (0.52) TK1RNASE1ALBPKMLMNA
SCHEMBL23734388 0.78 RNASE1 (0.61) TK1RNASE1ALBPKMLMNA
SCHEMBL20129801 0.76 RNASE1 (0.63) TK1RNASE1ALBPKMLMNA
SCHEMBL16489131 0.76 RNASE1 (0.63) TK1RNASE1ALBPKMLMNA
SCHEMBL28338723 0.75 TK1 (0.67) TK1RNASE1ALBPKMLMNA
SCHEMBL6224637 0.75 TK1 (0.67) TK1RNASE1ALBPKMLMNA
SCHEMBL24913674 0.75 RNASE1 (0.64) TK1RNASE1ALBPKMLMNA
SCHEMBL21787087 0.75 TK1 (0.46) TK1RNASE1TK2

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-20220389049-A1 REVERSIBLE TERMINATORS FOR DNA SEQUENCING AND METHODS OF USING THE SAME CENTRILLION TECHNOLOGY HOLDINGS CORPORATION (VG) 2022-12-08 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-20220389049-A1 REVERSIBLE TERMINATORS FOR DNA SEQUENCING AND METHODS OF USING THE SAME RNGTT, NT5C3B, NSUN2 TK1 51/4885RNASE1 89/4885TK2 79/4885

“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.