SCHEMBL5540396

SCHEMBL5540396

O=[C]OCCc1cc2c(F)cccc2o1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.35
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MKNK1 Q9BUB5 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
HTR2B P41595 2/20 0.32
MTNR1A P48039 3/20 0.31
MTNR1B P49286 3/20 0.31
ALB P02768 1/20 0.31
IL2 P60568 1/20 0.31
F2RL3 Q96RI0 2/20 0.31
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HTR3A P46098 1/20 0.30
AR P10275 1/20 0.30

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
SCHEMBL5543426 0.89 MTNR1A (0.35) PPARGMKNK1HTR2BMTNR1AMTNR1B
SCHEMBL5539271 0.86 PPARG (0.35) PPARGHTR2BMTNR1AMTNR1BF2RL3
SCHEMBL5542667 0.85 AGXT (0.34) PPARGNPC1HPGDRAB9ASMN1; SMN2
SCHEMBL5542228 0.77 CA12 (0.40) MKNK1F2RL3ATML3MBTL1
SCHEMBL5536540 0.76 MTNR1A (0.35) PPARGHTR2BMTNR1AMTNR1B
SCHEMBL28615153 0.73 ALOX15 (0.43) HTR2BMTNR1AMTNR1B
SCHEMBL5542277 0.72 CA12 (0.38) HTR2BATML3MBTL1
SCHEMBL5541845 0.72 L3MBTL1 (0.36) NPC1HPGDRAB9AF2RL3ATM
SCHEMBL17193877 0.72 NPC1 (0.36) PPARGNPC1HPGDRAB9ASMN1; SMN2
SCHEMBL16693135 0.72 IDO1 (0.37) PPARGNPC1HPGDRAB9ASMN1; 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 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 PPARG 856/4885NPC1 2404/4885HPGD 3159/4885

“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.