SCHEMBL5540477

SCHEMBL5540477

O=COC1CCN(c2ccccc2C(F)(F)C(F)(F)F)CC1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.37
NOTUM Q6P988 1/20 0.37
HCRTR2 O43614 1/20 0.36
AKR1C3 P42330 1/20 0.36
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
SCD O00767 6/20 0.34
RBP4 P02753 3/20 0.34
FFAR1 O14842 2/20 0.34
HSD11B1 P28845 1/20 0.33
F13A1 P00488 1/20 0.33
TGM2 P21980 1/20 0.33
TGM1 P22735 1/20 0.33

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
SCHEMBL5543282 0.89 AKR1C3 (0.46) TTRNOTUMHCRTR2AKR1C3SCD
SCHEMBL5540469 0.82 TTR (0.36) TTRNOTUMHCRTR2AKR1C3MEN1
SCHEMBL3436600 0.77 ADRB1 (0.47) AKR1C3FFAR1
SCHEMBL5542382 0.74 NOTUM (0.40) NOTUMAKR1C3FFAR1
SCHEMBL5541996 0.73 NOTUM (0.44) NOTUM
SCHEMBL5536223 0.72 MBTD1 (0.47) NOTUMUSP2FFAR1
SCHEMBL5542729 0.71 HTR1A (0.38) MEN1USP2GAAKMT2A
SCHEMBL29448003 0.71 AKR1C3 (0.48) TTRNOTUMHCRTR2AKR1C3RBP4
SCHEMBL5543275 0.70 AKR1C3 (0.45) TTRNOTUMHCRTR2AKR1C3SCD
SCHEMBL5535616 0.68 NOTUM (0.51) NOTUMAKR1C3

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 TTR 3990/4885NOTUM 3827/4885HCRTR2 268/4885

“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.