SCHEMBL5543997

SCHEMBL5543997

Cc1nc(-c2ccc(F)cc2)oc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
ALDH1A1 P00352 4/20 0.45
ALOX15 P16050 1/20 0.45
TP53 P04637 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
TSHR P16473 2/20 0.44
HSD17B10 Q99714 1/20 0.44
POLB P06746 2/20 0.43
USP2 O75604 1/20 0.43
KDM4E B2RXH2 3/20 0.42
NOTUM Q6P988 2/20 0.42
MAPT P10636 3/20 0.41
USP1 O94782 1/20 0.41
USP19 O94966 1/20 0.41
UCHL3 P15374 1/20 0.41
MAPK13 O15264 1/20 0.41
GCGR P47871 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41

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
SCHEMBL2706143 0.83 NPC1 (0.52) NPC1RAB9AALDH1A1TP53SMN1; SMN2
SCHEMBL18944680 0.81 NPC1 (0.48) NPC1RAB9AALDH1A1ALOX15TP53
SCHEMBL5543992 0.81 NPC1 (0.48) NPC1RAB9AALDH1A1ALOX15TP53
SCHEMBL14431592 0.80 GAA (0.54) NPC1RAB9AALDH1A1ALOX15SMN1; SMN2
SCHEMBL9862893 0.80 NPC1 (0.51) NPC1RAB9ASMN1; SMN2HSD17B10USP2
SCHEMBL24125061 0.80 RAB9A (0.52) NPC1RAB9AALDH1A1ALOX15TP53
SCHEMBL1557048 0.80 TARBP2 (0.53) NPC1RAB9AALDH1A1TP53SMN1; SMN2
SCHEMBL5534902 0.80 KDM4E (0.59) NPC1RAB9AALDH1A1ALOX15TP53
SCHEMBL13679017 0.79 PTPN1 (0.53) NPC1RAB9ASMN1; SMN2KDM4ENOTUM
SCHEMBL436384 0.79 GAA (0.57) NPC1RAB9AALDH1A1SMN1; SMN2TSHR

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
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
EP-1638963-B1 N-ACYL NITROGEN HETEROCYCLES AS LIGANDS OF PEROXISOME PROLIFERATOR-ACTIVATED RECEPTORS NOVARTIS AG (CH) 2009-09-09 EP disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
EP-1448523-B1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE NOVARTIS AG (CH) 2007-08-22 EP 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 NPC1 2404/4885RAB9A 2824/4885ALDH1A1 355/4885

“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.