SCHEMBL9201376

SCHEMBL9201376

Cc1cn([C@H]2CC(O)[C@@H](CON=[N+]=[N-])O2)c(=O)[nH]c1=O

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.63
TK1 P04183 4/20 0.61
LMNA P02545 2/20 0.61
TSHR P16473 2/20 0.61
ALB P02768 1/20 0.61
PKM P14618 1/20 0.61
BLM P54132 1/20 0.61
PMP22 Q01453 1/20 0.61
CYP2D6 P10635 1/20 0.61
ABCG2 Q9UNQ0 3/20 0.57
ABCB1 P08183 1/20 0.57

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
SCHEMBL34209 1.00 POLB (0.63) POLBTK1LMNATSHRALB
Ammonia Solution, Strong SCHEMBL30922192 0.99 POLB (0.62) POLBTK1LMNATSHRALB
SCHEMBL547923 0.88 POLB (0.66) POLBTK1
SCHEMBL9229137 0.88 TYMS (0.54) LMNA
SCHEMBL10380716 0.88 TK1 (0.58) POLBTK1LMNATSHRALB
SCHEMBL27677810 0.87 POLB (0.57) POLBTK1LMNATSHRALB
SCHEMBL1360475 0.86 TK1 (0.61) POLBTK1LMNATSHRALB
Thymidine Monophosphate SCHEMBL17075779 0.86 POLB (0.74) POLBTK1
Thymidine Monophosphate SCHEMBL9559854 0.84 POLB (0.78) POLBTK1
SCHEMBL17667452 0.84 TK1 (0.68) POLBTK1LMNATSHRALB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130041104-A1 CONJUGATES OF 18F CARRIERS HAVING BIOACTIVE, ORGANIC COMPOUNDS AND THE PREPARATION THEREOF APTENIA S.R.L. (IT) 2013-02-14 US disclosed
EP-0427843-B1 SPECIFIC INHIBITOR FOR RETROVIRUS REVERSE TRANSCRIPTASE, AND ITS APPLICATION AS A MEDICAMENT BLOUGH HERBERT A (US) 1995-03-08 EP 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-20130041104-A1 CONJUGATES OF 18F CARRIERS HAVING BIOACTIVE, ORGANIC COMPOUNDS AND THE PREPARATION THEREOF PAICS, PFAS, PIGO POLB 952/4885TK1 46/4885LMNA 1642/4885

“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.