SCHEMBL3083995

SCHEMBL3083995

C=COC(F)[C@H]1O[C@@H](n2cc(Br)c(=O)[nH]c2=O)C[C@@H]1OC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
RNASE1 P07998 1/20 0.37
PYGM P11217 1/20 0.36
TK1 P04183 4/20 0.35
P2RY6 Q15077 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL3087452 0.85 TK1 (0.43) SMN1; SMN2ALDH1A1POLBKMT2APYGM
SCHEMBL3078489 0.85 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1POLBKMT2ARNASE1
SCHEMBL3072361 0.83 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1POLBKMT2ARNASE1
SCHEMBL3089580 0.77 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1POLBKMT2ARNASE1
SCHEMBL9299848 0.77 RNASE1 (0.59) SMN1; SMN2RNASE1PYGMTK1LMNA
SCHEMBL15489691 0.77 RNASE1 (0.49) SMN1; SMN2ALDH1A1POLBKMT2ARNASE1
SCHEMBL15489639 0.77 RNASE1 (0.49) SMN1; SMN2ALDH1A1POLBKMT2ARNASE1
SCHEMBL14102225 0.77 LMNA (0.51) SMN1; SMN2RNASE1TK1LMNATSHR
SCHEMBL3084960 0.77 TK1 (0.47) SMN1; SMN2ALDH1A1POLBKMT2ATK1
SCHEMBL3978675 0.76 PYGM (0.54) SMN1; SMN2ALDH1A1POLBKMT2APYGM

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
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
EP-2054406-A1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY RESprotect GmbH (DE) 2009-05-06 EP disclosed
WO-2008017515-A1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY RESPROTECT GMBH (DE) 2008-02-14 WO 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 SMN1; SMN2 1379/4885ALDH1A1 1238/4885POLB 288/4885

“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.