SCHEMBL5545404

SCHEMBL5545404

Clc1ccc(OC2CCN(c3[c]cccc3)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.44
SLC6A4 P31645 2/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HTR2A P28223 2/20 0.41
HTR7 P34969 2/20 0.41
ACACB O00763 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HTR1A P08908 1/20 0.39
HTR6 P50406 1/20 0.39
FPR2 P25090 4/20 0.39
PROKR1 Q8TCW9 4/20 0.39
HRH3 Q9Y5N1 3/20 0.39
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
GAA P10253 1/20 0.38
ACLY P53396 1/20 0.38
CYP2C9 P11712 1/20 0.37
CYP2J2 P51589 1/20 0.37

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
SCHEMBL5536838 0.88 HRH1 (0.46) EPHX2SLC6A4SLC6A2SLC6A3SMN1; SMN2
SCHEMBL5543469 0.86 EPHX2 (0.44) EPHX2HTR2AHTR7SMN1; SMN2FPR2
SCHEMBL5547830 0.82 MMP13 (0.45) EPHX2ACACBSMN1; SMN2FPR2PROKR1
SCHEMBL5537304 0.80 MMP13 (0.41) EPHX2SMN1; SMN2FPR2PROKR1HRH3
SCHEMBL5544536 0.80 ACACB (0.38) ACACBSMN1; SMN2HRH3
SCHEMBL2088787 0.78 LTA4H (0.44) ACACBHRH3MEN1KMT2A
SCHEMBL5539371 0.78 CARM1 (0.37) ACACBSMN1; SMN2HRH3
SCHEMBL998037 0.75 OGA (0.38) SLC6A2SLC6A3HTR1AHRH3
SCHEMBL10926737 0.75 DRD4 (0.50) HTR2ASMN1; SMN2HTR1ALMNAKMT2A
SCHEMBL2094944 0.75 SLC6A2 (0.39) EPHX2SLC6A4SLC6A2SLC6A3SMN1; SMN2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
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 EPHX2 3662/4885SLC6A4 4191/4885SLC6A2 3396/4885

“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.