SCHEMBL5536711

SCHEMBL5536711

[O]c1ccc2c(c1)CCCC2=O

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 13/20 0.63
▸ MAOB P27338 13/20 0.63
▸ PRKCI P41743 1/20 0.63
▸ HSD17B1 P14061 2/20 0.56
▸ CYP2A6 P11509 1/20 0.55
▸ GRM5 P41594 1/20 0.53
▸ BAZ2B Q9UIF8 1/20 0.51
▸ MEN1 O00255 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ CASP1 P29466 1/20 0.47
▸ CASP7 P55210 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ PGR P06401 1/20 0.43

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
SCHEMBL5538267 0.87 CASP1 (0.61) MAOAMAOBPRKCIHSD17B1CYP2A6
SCHEMBL5543621 0.83 MAOA (0.55) MAOAMAOBPRKCIHSD17B1CYP2A6
SCHEMBL929312 0.78 CASP1 (0.78) MAOAMAOBPRKCIHSD17B1CYP2A6
SCHEMBL1798900 0.78 MAOA (0.67) MAOAMAOBPRKCIHSD17B1CYP2A6
SCHEMBL228128 0.78 MAOA (1.00) MAOAMAOBPRKCIHSD17B1CYP2A6
SCHEMBL8131108 0.78 MAOA (0.61) MAOAMAOBPRKCIHSD17B1CYP2A6
SCHEMBL207834 0.78 MAOA (0.61) MAOAMAOBPRKCIHSD17B1CYP2A6
SCHEMBL5858951 0.78 MAOA (0.61) MAOAMAOBPRKCIHSD17B1CYP2A6
SCHEMBL1027718 0.78 MAOA (0.61) MAOAMAOBPRKCIHSD17B1CYP2A6
SCHEMBL315147 0.78 MAOA (0.61) MAOAMAOBPRKCIHSD17B1CYP2A6

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-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
EP-0574906-B1 Piperazine and homopiperazine derivatives, pharmaceutical compositions containing them and process for preparing the same NISSHIN FLOUR MILLING CO (JP) 2001-08-22 — — 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 MAOA 2885/4885MAOB 2140/4885PRKCI 3430/4885

“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.

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