SCHEMBL3072159

SCHEMBL3072159

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

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 2/20 0.42
TYMS P04818 2/20 0.41
TK1 P04183 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PYGM P11217 1/20 0.40
ALOX12 P18054 1/20 0.40
ADRA1A P35348 1/20 0.40
BCHE P06276 1/20 0.40

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
SCHEMBL3066260 0.88 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1POLBKMT2ALMNA
SCHEMBL1172397 0.87 TYMS (0.54) SMN1; SMN2LMNATYMSTK1CYP1A2
SCHEMBL3066252 0.87 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1POLBKMT2ALMNA
SCHEMBL3078239 0.85 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1POLBKMT2ATYMS
SCHEMBL3078011 0.83 TK2 (0.44) SMN1; SMN2ALDH1A1POLBKMT2ATYMS
SCHEMBL17135519 0.82 TK1 (0.56) SMN1; SMN2ALDH1A1POLBKMT2ALMNA
SCHEMBL2041364 0.82 LMNA (0.58) SMN1; SMN2LMNATK1CYP1A2CYP3A4
SCHEMBL2041365 0.82 LMNA (0.58) SMN1; SMN2LMNATK1CYP1A2CYP3A4
SCHEMBL2041369 0.82 LMNA (0.58) SMN1; SMN2LMNATK1CYP1A2CYP3A4
SCHEMBL3079656 0.80 TOP2A (0.42) SMN1; SMN2ALDH1A1POLBKMT2ATYMS

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 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.