SCHEMBL5541407

SCHEMBL5541407

O=[C]OCCC/C=C/Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 1/20 0.53
MAOB P27338 1/20 0.50
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
ARG2 P78540 1/20 0.37
KCNH2 Q12809 2/20 0.34
EPHX2 P34913 5/20 0.32
FAAH O00519 3/20 0.32
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
CNR1 P21554 2/20 0.31
CNR2 P34972 2/20 0.31
IDO1 P14902 2/20 0.31
MAPT P10636 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL5541411 1.00 TOP1 (0.53) TOP1MAOBCA1CA2ARG2
SCHEMBL5539392 0.90 MAOB (0.54) TOP1MAOBCA1CA2ARG2
SCHEMBL5539395 0.90 MAOB (0.54) TOP1MAOBCA1CA2ARG2
SCHEMBL5542917 0.84 KCNH2 (0.38) TOP1MAOBKCNH2IDO1
SCHEMBL5542921 0.84 KCNH2 (0.38) TOP1MAOBKCNH2IDO1
SCHEMBL4400542 0.79 MAOB (0.58) TOP1MAOBCA1CA2ARG2
SCHEMBL4400539 0.79 MAOB (0.58) TOP1MAOBCA1CA2ARG2
SCHEMBL5538103 0.78 IDO1 (0.42) HDAC1HDAC2IDO1
SCHEMBL5538100 0.78 IDO1 (0.42) HDAC1HDAC2IDO1
SCHEMBL96728 0.77 TOP1 (0.57) TOP1MAOBCA1CA2ARG2

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 TOP1 1107/4885MAOB 2140/4885CA1 3493/4885

“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.