SCHEMBL5540580

SCHEMBL5540580

[CH2]CCCCC(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 12/20 0.57
WNT3A P56704 12/20 0.57
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
F2R P25116 1/20 0.39
CNR2 P34972 1/20 0.39

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
SCHEMBL5546771 0.98 CTNNB1 (0.56) CTNNB1WNT3ALMNAGAAHDAC3
SCHEMBL5543911 0.95 CTNNB1 (0.59) CTNNB1WNT3ALMNAGAAHDAC3
SCHEMBL2096286 0.88 CTNNB1 (0.62) CTNNB1WNT3ALMNAGAAF2R
SCHEMBL30089582 0.84 CTNNB1 (0.75) CTNNB1WNT3ALMNAGAAF2R
SCHEMBL5660835 0.84 CTNNB1 (0.58) CTNNB1WNT3ALMNAGAAHDAC3
SCHEMBL27629360 0.84 CTNNB1 (0.57) CTNNB1WNT3ALMNAGAAF2R
SCHEMBL5851305 0.83 CTNNB1 (0.60) CTNNB1WNT3ALMNAGAAHDAC3
SCHEMBL24775562 0.82 CTNNB1 (0.59) CTNNB1WNT3ALMNAGAAHDAC3
SCHEMBL3732487 0.82 CTNNB1 (0.59) CTNNB1WNT3ALMNAGAAF2R
SCHEMBL31525070 0.82 CTNNB1 (0.59) CTNNB1WNT3ALMNAGAAHDAC3

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 CTNNB1 2465/4885WNT3A 3020/4885LMNA 4152/4885

“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.