SCHEMBL5546653

SCHEMBL5546653

[CH2]c1cccc(Oc2ccc(OC(F)(F)F)cc2Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.44
ERBB2 P04626 4/20 0.44
ERBB3 P21860 4/20 0.44
ERBB4 Q15303 4/20 0.44
PNLIP P16233 1/20 0.40
SCN9A Q15858 4/20 0.39
MRGPRX4 Q96LA9 2/20 0.39
BRAF P15056 1/20 0.38
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
CTSC P53634 1/20 0.37
AR P10275 1/20 0.36

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
SCHEMBL11114021 0.83 L3MBTL1 (0.50) EGFRERBB2ERBB3ERBB4PNLIP
SCHEMBL11214221 0.81 FFAR1 (0.48) EGFRERBB2ERBB3ERBB4MRGPRX4
SCHEMBL98062 0.81 GPR3 (0.42)
SCHEMBL5544915 0.80 CETP (0.43) SCN9A
SCHEMBL5542355 0.79 MRGPRX4 (0.59) MRGPRX4
SCHEMBL5542862 0.78 PNLIP (0.43) EGFRERBB2ERBB3ERBB4PNLIP
SCHEMBL2747591 0.78 EGFR (0.50) EGFRERBB2ERBB3ERBB4PNLIP
SCHEMBL10825618 0.76 MRGPRX4 (0.48) PNLIPSCN9AMRGPRX4PPARDPPARA
SCHEMBL2091984 0.76 SCN3A (0.48) PNLIPSCN9AMRGPRX4PPARDPPARA
SCHEMBL5538831 0.75 DHODH (0.45) SCN9ATHRATHRBCTSC

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 6 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
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN 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 EGFR 3049/4885ERBB2 1929/4885ERBB3 1457/4885

“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.