SCHEMBL3082887

SCHEMBL3082887

C=C(Br)c1cn([C@H]2CC(NC(C)=O)[C@@H](CBr)O2)c(=O)[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TK2 O00142 2/20 0.46
TK1 P04183 4/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DTYMK P23919 1/20 0.39
RNASE1 P07998 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL3078009 0.92 TK2 (0.55) TK2TK1LMNASMN1; SMN2DTYMK
SCHEMBL3082906 0.82 LMNA (0.44) TK2TK1LMNASMN1; SMN2CYP1A2
SCHEMBL3066353 0.82 TK1 (0.55) TK2TK1LMNASMN1; SMN2CYP1A2
SCHEMBL3082894 0.81 TK1 (0.61) TK2TK1CYP1A2CYP3A4TSHR
SCHEMBL3082891 0.81 TK1 (0.61) TK2TK1CYP1A2CYP3A4TSHR
SCHEMBL3071137 0.81 TK1 (0.43) TK2TK1LMNASMN1; SMN2CYP1A2
SCHEMBL3090116 0.80
SCHEMBL3085741 0.79
SCHEMBL3065258 0.77 TK1 (0.43) TK2TK1LMNASMN1; SMN2CYP1A2
SCHEMBL3076872 0.77 TK1 (0.54) TK2TK1LMNASMN1; SMN2CYP1A2

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 34/4885TK1 40/4885LMNA 1868/4885

“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.