SCHEMBL5542537

SCHEMBL5542537

FC(F)(F)c1ccc(OC2CCN(c3c[c]ccc3)CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.43
EPHX2 P34913 1/20 0.43
MMP13 P45452 5/20 0.42
MMP2 P08253 4/20 0.42
TEAD1 P28347 1/20 0.42
MMP12 P39900 1/20 0.41
LIPG Q9Y5X9 3/20 0.41
LIPC P11150 1/20 0.41
FPR2 P25090 1/20 0.41
PROKR1 Q8TCW9 1/20 0.41
ACACB O00763 2/20 0.41
FFAR1 O14842 1/20 0.41
SCN9A Q15858 2/20 0.41
KCNH2 Q12809 1/20 0.41
SCN5A Q14524 1/20 0.41
ADRB2 P07550 1/20 0.40

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
SCHEMBL5542795 0.90 FFAR1 (0.38) LIPEEPHX2MMP13MMP2MMP12
SCHEMBL5539614 0.87 KCNH2 (0.45) EPHX2MMP13MMP2MMP12FPR2
SCHEMBL2096729 0.84 TEAD1 (0.45) LIPEEPHX2MMP13MMP2TEAD1
SCHEMBL2090413 0.84 FFAR4 (0.47) ACACB
SCHEMBL5545312 0.83 HRH3 (0.41) EPHX2MMP13MMP12FPR2PROKR1
SCHEMBL28818515 0.80 HTR2C (0.45)
SCHEMBL12441780 0.77 HTR1A (0.47) LIPEMMP13MMP2TEAD1LIPG
SCHEMBL2091975 0.77 TEAD1 (0.47) LIPEEPHX2MMP13MMP2TEAD1
SCHEMBL13279685 0.77 DEGS1 (0.48) LIPEEPHX2MMP13MMP2TEAD1
SCHEMBL28818529 0.77 TEAD1 (0.44) LIPEEPHX2MMP13MMP2TEAD1

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 LIPE 4705/4885EPHX2 3662/4885MMP13 4355/4885

“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.