SCHEMBL5543239

SCHEMBL5543239

COC(=O)c1cccc(CO[C]=O)c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.62
CYP4F2 P78329 2/20 0.60
CYP4A11 Q02928 2/20 0.60
MRGPRX4 Q96LA9 6/20 0.57
MAPT P10636 3/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
KDM4E B2RXH2 2/20 0.56
ALDH1A1 P00352 2/20 0.56
SLC7A5 Q01650 1/20 0.54
TSHR P16473 2/20 0.50
NPC1 O15118 1/20 0.49
HIF1A Q16665 1/20 0.48
HPGD P15428 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
FOLH1 Q04609 1/20 0.47

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
SCHEMBL5546273 0.85 CYP4F2 (0.59) CYP4F2CYP4A11MRGPRX4MAPTRAB9A
SCHEMBL5537308 0.85 CYP4F2 (0.66) LOXL2CYP4F2CYP4A11MRGPRX4MAPT
SCHEMBL6000185 0.83 LOXL2 (0.70) LOXL2CYP4F2CYP4A11MRGPRX4MAPT
SCHEMBL31276343 0.83 LOXL2 (0.70) LOXL2CYP4F2CYP4A11MRGPRX4MAPT
SCHEMBL1544193 0.83 LOXL2 (0.70) LOXL2CYP4F2CYP4A11MRGPRX4MAPT
SCHEMBL7276073 0.82 FOLH1 (0.56) MRGPRX4RAB9ASMN1; SMN2NPC1HPGD
SCHEMBL3622638 0.81 LOXL2 (0.66) LOXL2CYP4F2CYP4A11MRGPRX4MAPT
SCHEMBL1715330 0.81 LOXL2 (0.71) LOXL2CYP4F2CYP4A11MRGPRX4MAPT
SCHEMBL7276383 0.81 LOXL2 (0.66) LOXL2CYP4F2CYP4A11MRGPRX4MAPT
SCHEMBL5546604 0.80 LOXL2 (0.58) LOXL2CYP4F2CYP4A11MAPTRAB9A

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 8 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
EP-0509769-B1 Heterocyclic amides having HLE inhibiting activity ZENECA LTD (GB) 1996-09-11 EP disclosed
US-5521179-A Heterocyclic amides ZENECA LIMITED (GB) 1996-05-28 US disclosed
EP-0509769-A2 Heterocyclic amides having HLE inhibiting activity ZENECA LIMITED (GB) 1992-10-21 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 LOXL2 3768/4885CYP4F2 954/4885CYP4A11 1804/4885

“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.