SCHEMBL16209652

SCHEMBL16209652

O=[N+]([O-])c1ccc(N2CCN(P(=O)(O)Cl)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 2/20 0.58
POLB P06746 2/20 0.58
MAPT P10636 7/20 0.57
ALDH1A1 P00352 4/20 0.54
ADRB1 P08588 1/20 0.54
GAA P10253 2/20 0.54
LMNA P02545 4/20 0.52
AKR1C3 P42330 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.51
MAPK1 P28482 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL28481170 0.82 SIRT6 (0.55) SIRT6POLBMAPTALDH1A1ADRB1
SCHEMBL15271381 0.82 SIRT6 (0.81) SIRT6POLBMAPTALDH1A1ADRB1
SCHEMBL6151230 0.82 SIRT6 (0.81) SIRT6POLBMAPTALDH1A1ADRB1
SCHEMBL28481169 0.78 SIRT6 (0.56) SIRT6POLBMAPTALDH1A1ADRB1
SCHEMBL14995047 0.77 TSHR (0.47) POLBMAPTALDH1A1LMNAAKR1C3
SCHEMBL3891177 0.77 MAPT (0.70) SIRT6POLBMAPTALDH1A1ADRB1
SCHEMBL7048817 0.77 MAPT (0.85) SIRT6POLBMAPTALDH1A1ADRB1
SCHEMBL12952781 0.75 SIRT6 (0.71) SIRT6POLBMAPTALDH1A1ADRB1
SCHEMBL3012718 0.75 AKR1C3 (0.67) SIRT6POLBMAPTALDH1A1LMNA
SCHEMBL11194107 0.75 AKR1C3 (0.62) SIRT6POLBMAPTALDH1A1LMNA

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
US-11208655-B2 Functionally-modified oligonucleotides and subunits thereof SAREPTA THERAPEUTICS, INC. (US) 2021-12-28 US disclosed
US-20200115709-A1 Functionally-Modified Oligonucleotides And Subunits Thereof JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2020-04-16 US disclosed
US-9790499-B2 Functionally-modified oligonucleotides and subunits thereof SAREPTA THERAPEUTICS, INC. (US) 2017-10-17 US disclosed
US-9278987-B2 Functionally-modified oligonucleotides and subunits thereof SAREPTA THERAPEUTICS, INC. (US) 2016-03-08 US disclosed
US-20140330006-A1 FUNCTIONALLY-MODIFIED OLIGONUCLEOTIDES AND SUBUNITS THEREOF SAREPTA THERAPEUTICS, INC. (US) 2014-11-06 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 (3 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-11208655-B2 Functionally-modified oligonucleotides and subunits thereof RTCB, NSUN3, NSUN2 SIRT6 3520/4885POLB 159/4885MAPT 3393/4885
US-20140330006-A1 FUNCTIONALLY-MODIFIED OLIGONUCLEOTIDES AND SUBUNITS THEREOF RTCB, NSUN3, NSUN2 SIRT6 3520/4885POLB 159/4885MAPT 3393/4885
US-20200115709-A1 Functionally-Modified Oligonucleotides And Subunits Thereof RTCB, NSUN3, NSUN2 SIRT6 3520/4885POLB 159/4885MAPT 3393/4885

“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.