SCHEMBL5539592

SCHEMBL5539592

O=COCc1ccccc1C(F)(F)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.43
MAOB P27338 4/20 0.36
MAOA P21397 1/20 0.36
FFAR4 Q5NUL3 2/20 0.34
AR P10275 1/20 0.33
SRC P12931 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
TACR1 P25103 1/20 0.31
FFAR1 O14842 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL2091829 0.86 IDO1 (0.59) IDO1MAOBMAOAFFAR4AR
SCHEMBL11406620 0.77 SRC (0.40) IDO1SRCKDM4EALDH1A1
SCHEMBL5539587 0.76 IDO1 (0.43) IDO1MAOBMAOAFFAR4RXRA
SCHEMBL5537022 0.76 IDO1 (0.43) IDO1MAOBMAOAFFAR4AR
SCHEMBL5545714 0.75 GRIN1 (0.33) IDO1SRCRXRARXRBRXRG
SCHEMBL18242814 0.74 IDO1 (0.38) IDO1MAOBMAOAARKDM4E
SCHEMBL5534582 0.72 ADH1B (0.44) IDO1KDM4EALDH1A1
SCHEMBL2090205 0.72 GRIN2B (0.42) RXRARXRBRXRG
SCHEMBL98043 0.72 IDO1 (0.55) IDO1MAOBKDM4EALDH1A1
SCHEMBL5542287 0.71 FFAR4 (0.52) IDO1FFAR4FFAR1ALDH1A1

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 IDO1 3181/4885MAOB 2140/4885MAOA 2885/4885

“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.