SCHEMBL3078293

SCHEMBL3078293

C=CC(OC(=O)CNC(=O)OC(C)(C)C)[C@H]1O[C@@H](n2cc(Br)c(=O)[nH]c2=O)C[C@@H]1Cl

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TK2 O00142 4/20 0.35
EPHX2 P34913 1/20 0.34
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL3082515 0.86 KMT2A (0.35) ALDH1A1POLBKMT2ASMN1; SMN2
SCHEMBL3078265 0.84 KMT2A (0.35) ALDH1A1POLBKMT2ASMN1; SMN2
SCHEMBL3075364 0.83 TK2 (0.43) TK2ALDH1A1POLBKMT2ASMN1; SMN2
SCHEMBL3082773 0.82 TK2 (0.47) TK2
SCHEMBL3066218 0.77 ALDH1A1 (0.39) ALDH1A1POLBKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL3085583 0.77 SMN1; SMN2 (0.32) ALDH1A1POLBKMT2ASMN1; SMN2
SCHEMBL3085747 0.75 ALDH1A1 (0.39) ALDH1A1POLBKMT2ASMN1; SMN2
SCHEMBL3071139 0.74 SMN1; SMN2 (0.45) ALDH1A1POLBKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL3089959 0.74
SCHEMBL3084969 0.73 KMT2A (0.37) TK2ALDH1A1POLBKMT2ASMN1; SMN2

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
EP-2054406-B1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY RESPROTECT GMBH (DE) 2015-10-07 EP disclosed
US-8492537-B2 Nucleosides for suppressing or reducing the development of resistance in cytostatic therapy RESPROTECT GMBH (DE) 2013-07-23 US disclosed
US-20100227834-A1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY RESprotech GmbH (DE) 2010-09-09 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-20100227834-A1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY TYMP, ENTPD5, NTPCR TK2 34/4885EPHX2 2363/4885ALDH1A1 1238/4885

“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.