SCHEMBL5548424

SCHEMBL5548424

Cc1cc(-c2ccccc2C)ccc1OC(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 4/20 0.53
AR P10275 1/20 0.47
PDK2 Q15119 1/20 0.47
SCN5A Q14524 1/20 0.46
SCN9A Q15858 3/20 0.43
TRPA1 O75762 1/20 0.43
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40

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
SCHEMBL5548421 0.86 S1PR1 (0.44) S1PR1SCN5ASCN9ATRPA1FFAR1
SCHEMBL3939209 0.81 MCL1 (0.59) S1PR1ARPDK2SCN9AFFAR4
SCHEMBL16574099 0.80 SCN5A (0.43) S1PR1SCN5AFFAR1FFAR4
SCHEMBL21508410 0.80 SCN5A (0.43) S1PR1SCN5AFFAR1FFAR4
SCHEMBL7936555 0.79 HTR2C (0.52) S1PR1
SCHEMBL5535236 0.77 S1PR1 (0.44) S1PR1ARPDK2SCN5AFFAR1
SCHEMBL2955033 0.77 S1PR1 (0.56) S1PR1SCN9ATRPA1
SCHEMBL5542629 0.77 ADORA2A (0.47) S1PR1ARPDK2SCN9A
SCHEMBL14499540 0.76 SCN5A (0.43) S1PR1SCN5ASCN9AFFAR1FFAR4
SCHEMBL26375395 0.76 S1PR1 (0.55) S1PR1ARSCN9ATRPA1

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 S1PR1 3596/4885AR 254/4885PDK2 460/4885

“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.