SCHEMBL7613877

SCHEMBL7613877

O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2F)cc1C=CI

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TK2 O00142 8/20 0.67
PYGM P11217 3/20 0.54
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
TSHR P16473 1/20 0.51
TK1 P04183 1/20 0.51
BLM P54132 1/20 0.51
PMP22 Q01453 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL7612600 1.00 TK2 (0.67) TK2PYGMCYP1A2CYP3A4TSHR
SCHEMBL29519888 1.00 TK2 (0.67) TK2PYGMCYP1A2CYP3A4TSHR
SCHEMBL7612603 1.00 TK2 (0.67) TK2PYGMCYP1A2CYP3A4TSHR
SCHEMBL7612597 1.00 TK2 (0.67) TK2PYGMCYP1A2CYP3A4TSHR
SCHEMBL1619757 0.91 TK2 (0.81) TK2PYGMCYP1A2CYP3A4TSHR
SCHEMBL3071103 0.91 TK2 (0.81) TK2PYGMCYP1A2CYP3A4TSHR
SCHEMBL2924506 0.91 TK2 (0.81) TK2PYGMCYP1A2CYP3A4TSHR
SCHEMBL3071100 0.91 TK2 (0.81) TK2PYGMCYP1A2CYP3A4TSHR
SCHEMBL16003484 0.91 TK2 (0.81) TK2PYGMCYP1A2CYP3A4TSHR
SCHEMBL3191951 0.91 TK2 (0.81) TK2PYGMCYP1A2CYP3A4TSHR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685904-B2 Recombinant vaccinia virus and methods of use thereof Ignite Immunotherapy, Inc. (US) 2023-06-27 US disclosed
EP-3923967-A1 RECOMBINANT VACCINIA VIRUS AND METHODS OF USE THEREOF Ignite Immunotherapy, Inc. (US) 2021-12-22 EP disclosed
WO-2020165730-A1 RECOMBINANT VACCINIA VIRUS AND METHODS OF USE THEREOF Ignite Immunotherapy, Inc. (US) 2020-08-20 WO disclosed
US-20200263145-A1 RECOMBINANT VACCINIA VIRUS AND METHODS OF USE THEREOF Ignite Immunotherapy, Inc. (US) 2020-08-20 US disclosed
US-20020025296-A1 Combined use of nucleoside analogues and gene transfection for tissue imaging and therapy ALBERTA, GOVERNORS OF THE UNIVERSITY OF, THE (CA) 2002-02-28 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 (3 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-20020025296-A1 Combined use of nucleoside analogues and gene transfection for tissue imaging and therapy SLC29A1, SLC29A2, TK1 TK2 26/4885PYGM 1427/4885CYP1A2 4515/4885
US-11685904-B2 Recombinant vaccinia virus and methods of use thereof TP53, DCLRE1B, VAC14 TK2 70/4885PYGM 975/4885CYP1A2 4458/4885
US-20200263145-A1 RECOMBINANT VACCINIA VIRUS AND METHODS OF USE THEREOF TP53, DCLRE1B, VAC14 TK2 70/4885PYGM 975/4885CYP1A2 4458/4885

“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.