SCHEMBL5539623

SCHEMBL5539623

[CH2]CCCc1cccc2c1C=CCO2

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.41
MTNR1B P49286 1/20 0.41
CYP2B6 P20813 1/20 0.36
CYP1A2 P05177 6/20 0.34
CYP1A1 P04798 5/20 0.34
CYP1B1 Q16678 5/20 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
SCHEMBL27518049 0.90 MTNR1A (0.42) MTNR1AMTNR1BCYP2B6CYP1A2CYP1A1
SCHEMBL6949192 0.84 MTNR1A (0.41) MTNR1AMTNR1BCYP2B6CYP1A2CYP1A1
SCHEMBL7667186 0.76 MTNR1A (0.39) MTNR1AMTNR1BCYP2B6CYP1A2CYP1A1
SCHEMBL6949187 0.75 MTNR1A (0.46) MTNR1AMTNR1BCYP2B6CYP1A2CYP1A1
SCHEMBL8611672 0.73 MTNR1A (0.50) MTNR1AMTNR1B
SCHEMBL31027144 0.72 MTNR1A (0.46) MTNR1AMTNR1BCYP2B6CYP1A2CYP1A1
SCHEMBL5541990 0.71 CYP2B6 (0.46) MTNR1AMTNR1BCYP2B6CYP1A2CYP1A1
SCHEMBL7499810 0.70 MTNR1A (0.44) MTNR1A
SCHEMBL30426474 0.69 TAAR1 (0.41) MTNR1AMTNR1BCYP2B6CYP1A2CYP1A1
SCHEMBL29016946 0.69 TAAR1 (0.41) MTNR1AMTNR1BCYP2B6CYP1A2CYP1A1

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 MTNR1A 1560/4885MTNR1B 1562/4885CYP2B6 758/4885

“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.