SCHEMBL5535905

SCHEMBL5535905

Cc1ccc(S(=O)(=O)OCC(C)(O)Cn2cc([N+](=O)[O-])nc2Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.41
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 4/20 0.36
SOS1 Q07889 1/20 0.35
MITF O75030 1/20 0.35
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.33
PSMD10 O75832 1/20 0.32
POLB P06746 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
EGFR P00533 1/20 0.31
ERBB2 P04626 1/20 0.31

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
SCHEMBL5539492 1.00 PKM (0.41) PKMKMT2AALDH1A1SOS1MITF
SCHEMBL14775138 0.88 PKM (0.40) PKMKMT2AALDH1A1SOS1MITF
SCHEMBL14775141 0.88 PKM (0.40) PKMKMT2AALDH1A1SOS1MITF
SCHEMBL5541968 0.85 ALDH1A1 (0.37) PKMKMT2AALDH1A1SOS1MITF
SCHEMBL5536364 0.85 ALDH1A1 (0.37) PKMKMT2AALDH1A1SOS1MITF
SCHEMBL5536543 0.78 PKM (0.42) PKMKMT2AALDH1A1SOS1MITF
SCHEMBL5536554 0.78 PKM (0.42) PKMKMT2AALDH1A1SOS1MITF
SCHEMBL13280888 0.77 PKM (0.40) PKMKMT2AALDH1A1SOS1MITF
SCHEMBL5543866 0.76 ALDH1A1 (0.37) PKMKMT2AALDH1A1SOS1MITF
SCHEMBL5543875 0.76 ALDH1A1 (0.37) PKMKMT2AALDH1A1SOS1MITF

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
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 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-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 PKM 4291/4885KMT2A 4267/4885ALDH1A1 355/4885

“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.