SCHEMBL20876133

SCHEMBL20876133

O=C(CCCS(=O)(=O)O)Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.59
MEN1 O00255 8/20 0.59
ALDH1A1 P00352 4/20 0.59
HPGD P15428 2/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
MAPT P10636 4/20 0.54
LMNA P02545 3/20 0.54
HTT P42858 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
HDAC1 Q13547 1/20 0.50
MAPK1 P28482 1/20 0.50
HSP90AA1 P07900 1/20 0.49

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
SCHEMBL7700654 0.86 MEN1 (0.69) KMT2AMEN1ALDH1A1HPGDCYP2C9
SCHEMBL15480439 0.85 MEN1 (0.68) KMT2AMEN1ALDH1A1HPGDCYP2C9
SCHEMBL18660186 0.85 MEN1 (0.68) KMT2AMEN1ALDH1A1HPGDCYP2C9
SCHEMBL14548190 0.81 MEN1 (0.63) KMT2AMEN1ALDH1A1HPGDCYP2C9
SCHEMBL7121725 0.81 KMT2A (0.70) KMT2AMEN1ALDH1A1HPGDCYP2C9
SCHEMBL1520465 0.81 MEN1 (0.84) KMT2AMEN1ALDH1A1HPGDCYP2C9
SCHEMBL4746770 0.81 MEN1 (0.63) KMT2AMEN1ALDH1A1HPGDCYP2C9
SCHEMBL16322249 0.79 MEN1 (0.61) KMT2AMEN1ALDH1A1HPGDCYP2C9
SCHEMBL15480467 0.79 MEN1 (0.78) KMT2AMEN1ALDH1A1HPGDCYP2C9
SCHEMBL16322460 0.79 MEN1 (0.61) KMT2AMEN1ALDH1A1HPGDCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11661398-B2 Cellular transport system for transferring a sulfonic acid construct carrying a cargo into the cytoplasm of a cell Scientist of Fortune, S.A. (LU) 2023-05-30 US disclosed
US-20210009513-A1 CELLULAR TRANSPORT SYSTEM FOR TRANSFERRING A SULFONIC ACID CONSTRUCT CARRYING A CARGO INTO THE CYTOPLASM OF A CELL Scientist of Fortune, S.A. (LU) 2021-01-14 US disclosed
EP-3692022-A1 CELLULAR TRANSPORT SYSTEM FOR TRANSFERRING A SULFONIC ACID CONSTRUCT CARRYING A CARGO INTO THE CYTOPLASM OF A CELL Scientist of Fortune S.A. (LU) 2020-08-12 EP disclosed
WO-2019068726-A1 CELLULAR TRANSPORT SYSTEM FOR TRANSFERRING A SULFONIC ACID CONSTRUCT CARRYING A CARGO INTO THE CYTOPLASM OF A CELL SCIENTIST OF FORTUNE S.A. (LU) 2019-04-11 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 (2 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-11661398-B2 Cellular transport system for transferring a sulfonic acid construct carrying a cargo into the cytoplasm of a cell GOT1, GGCT, TGM2 KMT2A 2449/4885MEN1 2818/4885ALDH1A1 1289/4885
US-20210009513-A1 CELLULAR TRANSPORT SYSTEM FOR TRANSFERRING A SULFONIC ACID CONSTRUCT CARRYING A CARGO INTO THE CYTOPLASM OF A CELL GOT1, GGCT, TGM2 KMT2A 2449/4885MEN1 2818/4885ALDH1A1 1289/4885

“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.