SCHEMBL5547585

SCHEMBL5547585

CCCCCCn1c[c]cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.46
NPC1 O15118 7/20 0.44
RAB9A P51151 7/20 0.44
HTT P42858 6/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
MAPK1 P28482 3/20 0.44
NPSR1 Q6W5P4 3/20 0.44
LMNA P02545 3/20 0.44
HSP90AA1 P07900 3/20 0.44
GALR3 O60755 2/20 0.44
POLB P06746 2/20 0.44
ATM Q13315 2/20 0.44
MAPT P10636 2/20 0.44
APOBEC3A P31941 2/20 0.44
APOBEC3G Q9HC16 2/20 0.44
KDM4E B2RXH2 1/20 0.44
RAD52 P43351 1/20 0.44
PAX8 Q06710 1/20 0.44
NR2F2 P24468 1/20 0.44
NOD2 Q9HC29 1/20 0.44

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
SCHEMBL5542676 0.98 NPC1 (0.42) TBXAS1NPC1RAB9AHTTSMN1; SMN2
SCHEMBL1984308 0.91
SCHEMBL5601524 0.70 NPC1 (0.57) TBXAS1NPC1RAB9AHTTSMN1; SMN2
SCHEMBL5604022 0.70 NPC1 (0.57) TBXAS1NPC1RAB9AHTTSMN1; SMN2
SCHEMBL5604253 0.70 NPC1 (0.57) TBXAS1NPC1RAB9AHTTSMN1; SMN2
SCHEMBL1792913 0.70 NPC1 (0.57) TBXAS1NPC1RAB9AHTTSMN1; SMN2
SCHEMBL5602162 0.70 NPC1 (0.57) TBXAS1NPC1RAB9AHTTSMN1; SMN2
SCHEMBL5603811 0.70 NPC1 (0.57) TBXAS1NPC1RAB9AHTTSMN1; SMN2
SCHEMBL5602339 0.70 NPC1 (0.57) TBXAS1NPC1RAB9AHTTSMN1; SMN2
SCHEMBL562381 0.70 NPC1 (0.57) TBXAS1NPC1RAB9AHTTSMN1; 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 10 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
CN-101255170-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-09-03 CN disclosed
CN-101172981-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-05-07 CN disclosed
CN-100366624-C 2, 3-dihydro-6-nitroimidazo [2,1-b ] * azole compounds OTSUKA PHARMA CO LTD (JP) 2008-02-06 CN 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 TBXAS1 2580/4885NPC1 2404/4885RAB9A 2824/4885

“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.