SCHEMBL5543599

SCHEMBL5543599

O=C(O)c1ccc(NC(=O)N2CCC3(CC2)Cn2cc([N+](=O)[O-])nc2O3)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 4/20 0.39
GAA P10253 1/20 0.39
FAAH O00519 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 2/20 0.36
TSHR P16473 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
KCNH2 Q12809 4/20 0.35
EPHX2 P34913 2/20 0.35
CYP1A2 P05177 1/20 0.35
S1PR2 O95136 1/20 0.35
TRPV1 Q8NER1 1/20 0.35

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
SCHEMBL5537221 0.91 TRPM8 (0.48) TRPM8GAAMEN1KMT2AALDH1A1
SCHEMBL5544407 0.87 GAA (0.47) TRPM8GAAMEN1KMT2AALDH1A1
SCHEMBL5541336 0.87 KCNH2 (0.39) TRPM8GAAKMT2AALDH1A1CYP3A4
SCHEMBL5546619 0.79 SMN1; SMN2 (0.43) GAAMEN1KMT2AALDH1A1HTT
SCHEMBL5544251 0.79 KDM4E (0.41) MEN1KMT2AALDH1A1
SCHEMBL5546023 0.78 KCNH2 (0.41) MEN1KMT2AALDH1A1TSHRHPGD
SCHEMBL14562825 0.78 KCNH2 (0.38) KCNH2
SCHEMBL5543446 0.76 KCNH2 (0.35) MEN1KMT2AALDH1A1CYP3A4TSHR
SCHEMBL5543648 0.74 KCNH2 (0.40) GAAMEN1KMT2AALDH1A1KCNH2
SCHEMBL5535073 0.74 KCNH2 (0.52) GAAMEN1KMT2AALDH1A1HPGD

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
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 TRPM8 3538/4885GAA 4165/4885FAAH 4363/4885

“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.