SCHEMBL5541542

SCHEMBL5541542

Cc1nc(-c2ccccc2Cl)c(C)o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
NPC1 O15118 2/20 0.49
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
HPGD P15428 2/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.45
HSD11B1 P28845 1/20 0.43
ALDH1A1 P00352 5/20 0.42
KMT2A Q03164 3/20 0.42
TSHR P16473 1/20 0.41
LMNA P02545 2/20 0.40
GPBAR1 Q8TDU6 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GLA P06280 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
USP2 O75604 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL4637896 0.82 NPC1 (0.47) MAPTNPC1PTGS1PTGS2HPGD
SCHEMBL5541531 0.82 NPC1 (0.47) MAPTNPC1PTGS1PTGS2HPGD
SCHEMBL10833758 0.78 NPC1 (0.44) MAPTNPC1PTGS1PTGS2HPGD
SCHEMBL5548035 0.78 MBNL1 (0.47) MAPTNPC1PTGS1HPGDTP53
SCHEMBL5547946 0.74 NPC1 (0.46) MAPTNPC1PTGS1PTGS2HPGD
SCHEMBL10832913 0.74 HSD11B1 (0.47) MAPTNPC1HSD17B10HSD11B1ALDH1A1
SCHEMBL10832282 0.73 KMT2A (0.45) MAPTNPC1HSD17B10ALDH1A1KMT2A
SCHEMBL5214925 0.72 MAPK13 (0.58) MAPTPTGS1PTGS2HPGDTP53
SCHEMBL10832274 0.72 RXRA (0.57) HSD17B10KMT2A
SCHEMBL5547942 0.71 NPC1 (0.43) MAPTNPC1PTGS1PTGS2HPGD

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
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
US-4596816-A Pharmaceuticals TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-06-24 US disclosed
EP-0092239-A2 Oxazole derivatives, production and use thereof Takeda Chemical Industries, Ltd. (JP) 1983-10-26 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 MAPT 4117/4885NPC1 2404/4885PTGS1 3838/4885

“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.