SCHEMBL5541589

SCHEMBL5541589

CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)OCC(C)(O)Cn1cc([N+](=O)[O-])nc1Cl

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.38
CHRM1 P11229 1/20 0.37
TRPM8 Q7Z2W7 12/20 0.35
LSS P48449 1/20 0.35
SOS1 Q07889 1/20 0.34

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
SCHEMBL5541581 1.00 KCNH2 (0.38) KCNH2CHRM1TRPM8LSSSOS1
SCHEMBL5541809 0.88 KCNH2 (0.39) KCNH2CHRM1
SCHEMBL5541799 0.88 KCNH2 (0.39) KCNH2CHRM1
SCHEMBL5534677 0.85 KCNH2 (0.40) KCNH2CHRM1TRPM8LSSSOS1
SCHEMBL5534674 0.85 KCNH2 (0.40) KCNH2CHRM1TRPM8LSSSOS1
SCHEMBL5534917 0.82 KMT2A (0.41) KCNH2
SCHEMBL5534918 0.82 KMT2A (0.41) KCNH2
SCHEMBL5538475 0.82 CHRM1 (0.41) KCNH2CHRM1
SCHEMBL5538482 0.82 CHRM1 (0.41) KCNH2CHRM1
SCHEMBL5539659 0.81 LSS (0.42) KCNH2LSS

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 KCNH2 3503/4885CHRM1 463/4885TRPM8 3538/4885

“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.